Name: Name:1-tert-butyl-2-(1-methyl-1H-pyrazol-4-yl)-5-oxopyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG01BH25
Rating: 90 (10 reviews)

1-tert-butyl-2-(1-methyl-1H-pyrazol-4-yl)-5-oxopyrrolidine-3-carboxylic acid

CAS No.:

1479954-34-1

Catalog Number:

AG01BH25

Molecular Formula:

C13H19N3O3

Molecular Weight:

265.3083

Catalog Number:

AG01BH25

Chemical Name:

1-tert-butyl-2-(1-methyl-1H-pyrazol-4-yl)-5-oxopyrrolidine-3-carboxylic acid

CAS Number:

1479954-34-1

Molecular Formula:

C13H19N3O3

Molecular Weight:

265.3083

MDL Number:

MFCD19385622

IUPAC Name:

1-tert-butyl-2-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C13H19N3O3/c1-13(2,3)16-10(17)5-9(12(18)19)11(16)8-6-14-15(4)7-8/h6-7,9,11H,5H2,1-4H3,(H,18,19)

InChI Key:

YEHOWNNNRIBDQB-UHFFFAOYSA-N

SMILES:

OC(=O)C1CC(=O)N(C1c1cnn(c1)C)C(C)(C)C

Complexity:

391

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

265.143g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

265.313g/mol

Monoisotopic Mass:

265.143g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2