2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide

C15H19N3O2 — CID 119335110

IUPAC2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide
SMILESCCCC(N)C(=O)NCc1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C15H19N3O2/c1-2-5-12(16)15(20)17-9-10-8-14(19)18-13-7-4-3-6-11(10)13/h3-4,6-8,12H,2,5,9,16H2,1H3,(H,17,20)(H,18,19)
InChIKeyQJGHTCSSQKRAJJ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.27
Rot. Bonds5

About 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide

2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide (PubChem CID 119335110) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide
PubChem CID119335110
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide
SMILESCCCC(N)C(=O)NCc1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C15H19N3O2/c1-2-5-12(16)15(20)17-9-10-8-14(19)18-13-7-4-3-6-11(10)13/h3-4,6-8,12H,2,5,9,16H2,1H3,(H,17,20)(H,18,19)
InChIKeyQJGHTCSSQKRAJJ-UHFFFAOYSA-N
XLogP1.27
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
CID 166383305
2-methyl-3-(methylamino)-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide;hydrochloride
CID 119803749
2-amino-N-[(2-ethylphenyl)methyl]pentanamide;hydrochloride
CID 119331955
2-amino-N-benzylpentanamide
CID 11020044
1-[(2-oxo-1H-quinolin-4-yl)methyl]-3-[(2R)-2-phenylbutyl]urea
CID 97033524
(2R)-2-amino-N-[[2-[(dimethylamino)methyl]phenyl]methyl]pentanamide
CID 103813347
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]pentanamide
CID 93359004
N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
CID 166427421
2-amino-N-[(2-ethylphenyl)methyl]hexanamide
CID 64682652
3-amino-4-(1H-indol-3-ylmethylamino)-4-oxobutanoic acid
CID 115181305
2,3,6-trifluoro-N-[(2-oxo-1H-quinolin-4-yl)methyl]benzamide
CID 86798272
2-amino-N-[(2-cyclobutyloxyphenyl)methyl]pentanamide
CID 119330646

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide?
The IUPAC name of 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide (CID 119335110) is 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide.
What is the SMILES notation for 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide?
The canonical SMILES for 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide is CCCC(N)C(=O)NCc1cc(=O)[nH]c2ccccc12.
What is the InChIKey of 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide?
The InChIKey is QJGHTCSSQKRAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-5-12(16)15(20)17-9-10-8-14(19)18-13-7-4-3-6-11(10)13/h3-4,6-8,12H,2,5,9,16H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide?
2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide has a molecular weight of 273.34 g/mol, XLogP of 1.27, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2-oxo-1H-quinolin-4-yl)methyl]pentanamide is sourced from PubChem (CID 119335110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).