Name: Name:1-[1-(2-methoxyethyl)-1H-pyrazol-4-yl]-5-oxopyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG01ANGZ
Rating: 90 (10 reviews)

1-[1-(2-methoxyethyl)-1H-pyrazol-4-yl]-5-oxopyrrolidine-3-carboxylic acid

CAS No.:

1275458-73-5

Catalog Number:

AG01ANGZ

Molecular Formula:

C11H15N3O4

Molecular Weight:

253.2545

Catalog Number:

AG01ANGZ

Chemical Name:

1-[1-(2-methoxyethyl)-1H-pyrazol-4-yl]-5-oxopyrrolidine-3-carboxylic acid

CAS Number:

1275458-73-5

Molecular Formula:

C11H15N3O4

Molecular Weight:

253.2545

MDL Number:

MFCD16191770

IUPAC Name:

1-[1-(2-methoxyethyl)pyrazol-4-yl]-5-oxopyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C11H15N3O4/c1-18-3-2-13-7-9(5-12-13)14-6-8(11(16)17)4-10(14)15/h5,7-8H,2-4,6H2,1H3,(H,16,17)

InChI Key:

JMMZQBSVBGRQNI-UHFFFAOYSA-N

SMILES:

COCCn1ncc(c1)N1CC(CC1=O)C(=O)O

Complexity:

336

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.258g/mol

Monoisotopic Mass:

253.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.4