Name: Name:4-(2-aminoethyl)-3-ethyl-1-[(2-methylphenyl)methyl]-4,5-dihydro-1H-pyrazol-5-one
Brand: Angene
SKU: AG01BF4E
Rating: 90 (10 reviews)

4-(2-aminoethyl)-3-ethyl-1-[(2-methylphenyl)methyl]-4,5-dihydro-1H-pyrazol-5-one

CAS No.:

1489226-12-1

Catalog Number:

AG01BF4E

Molecular Formula:

C15H21N3O

Molecular Weight:

259.3467

Catalog Number:

AG01BF4E

Chemical Name:

4-(2-aminoethyl)-3-ethyl-1-[(2-methylphenyl)methyl]-4,5-dihydro-1H-pyrazol-5-one

CAS Number:

1489226-12-1

Molecular Formula:

C15H21N3O

Molecular Weight:

259.3467

MDL Number:

MFCD19400399

IUPAC Name:

4-(2-aminoethyl)-5-ethyl-2-[(2-methylphenyl)methyl]-4H-pyrazol-3-one

InChI:

InChI=1S/C15H21N3O/c1-3-14-13(8-9-16)15(19)18(17-14)10-12-7-5-4-6-11(12)2/h4-7,13H,3,8-10,16H2,1-2H3

InChI Key:

LNDHSAUHPLODOY-UHFFFAOYSA-N

SMILES:

NCCC1C(=NN(C1=O)Cc1ccccc1C)CC

Complexity:

353

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.168g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.353g/mol

Monoisotopic Mass:

259.168g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5