N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide

C14H14ClN3O2 — CID 16786560

IUPACN-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESNc1ccc(Cl)cc1NC(=O)CCn1ccccc1=O
InChIInChI=1S/C14H14ClN3O2/c15-10-4-5-11(16)12(9-10)17-13(19)6-8-18-7-2-1-3-14(18)20/h1-5,7,9H,6,8,16H2,(H,17,19)
InChIKeyWDHSPDJFVQAMAS-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.11
Rot. Bonds4

About N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide

N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 16786560) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID16786560
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC NameN-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESNc1ccc(Cl)cc1NC(=O)CCn1ccccc1=O
InChIInChI=1S/C14H14ClN3O2/c15-10-4-5-11(16)12(9-10)17-13(19)6-8-18-7-2-1-3-14(18)20/h1-5,7,9H,6,8,16H2,(H,17,19)
InChIKeyWDHSPDJFVQAMAS-UHFFFAOYSA-N
XLogP2.11
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-5-chlorophenyl)-3-(2-oxopyrimidin-1-yl)propanamide
CID 16790211
N-(2-amino-4-fluorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 16788694
N-(2-amino-5-chlorophenyl)-3-(3-ethyl-2-oxoimidazol-1-yl)propanamide
CID 80579081
3-(2-oxo-1-pyridinyl)propanehydrazide
CID 43346089
N-(2-amino-4-chlorophenyl)-3-(6-oxopyridazin-1-yl)propanamide
CID 62850123
N-(2-aminophenyl)-3-(5-chloro-2,4-dioxopyrimidin-1-yl)propanamide
CID 66423760
N-(2-amino-5-chlorophenyl)-3-(2-oxopiperidin-1-yl)propanamide
CID 28823865
N-(2-amino-5-chlorophenyl)-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide
CID 28526956
N-(2-amino-5-chlorophenyl)-2-(1,3-dihydroisoindol-2-yl)acetamide
CID 62206390
N-(2-amino-5-chlorophenyl)-2-phenylacetamide
CID 18071244
N-(2-amino-5-chlorophenyl)-2-(5-bromo-2-oxo-1-pyridinyl)acetamide
CID 28532600
N-(5-fluoro-2-methylphenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979424

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide (CID 16786560) is N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide is Nc1ccc(Cl)cc1NC(=O)CCn1ccccc1=O.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is WDHSPDJFVQAMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c15-10-4-5-11(16)12(9-10)17-13(19)6-8-18-7-2-1-3-14(18)20/h1-5,7,9H,6,8,16H2,(H,17,19).
What are the key properties of N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide?
N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 291.74 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 16786560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).