N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide

C15H17N3O2 — CID 63172233

IUPACN-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide
SMILESCc1cccn(CCC(=O)Nc2cccc(N)c2)c1=O
InChIInChI=1S/C15H17N3O2/c1-11-4-3-8-18(15(11)20)9-7-14(19)17-13-6-2-5-12(16)10-13/h2-6,8,10H,7,9,16H2,1H3,(H,17,19)
InChIKeyUPUMTUPTHHFNOA-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.77
Rot. Bonds4

About N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide

N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide (PubChem CID 63172233) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide
PubChem CID63172233
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide
SMILESCc1cccn(CCC(=O)Nc2cccc(N)c2)c1=O
InChIInChI=1S/C15H17N3O2/c1-11-4-3-8-18(15(11)20)9-7-14(19)17-13-6-2-5-12(16)10-13/h2-6,8,10H,7,9,16H2,1H3,(H,17,19)
InChIKeyUPUMTUPTHHFNOA-UHFFFAOYSA-N
XLogP1.77
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.77
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-(5-amino-2-methylphenyl)-3-(3-bromo-2-oxo-1-pyridinyl)propanamide
CID 114760027
N-(3-aminophenyl)-3-(2,6-dimethylphenoxy)propanamide
CID 16786452
N-(2-aminophenyl)-5-(3-methyl-2-oxo-1-pyridinyl)pentanamide
CID 82031878
N-(3-aminophenyl)-3-methyl-2-(3-methyl-2-oxo-1-pyridinyl)butanamide
CID 82031832
N-(2-cyanophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide
CID 63172291
N-(3-aminophenyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 16793646
N-(3-aminophenyl)-3-(2,4-dioxo-1,3-thiazolidin-3-yl)propanamide
CID 16792770
N-(3-aminophenyl)-3-(4-methyl-1,4-diazepan-1-yl)propanamide
CID 28744833
N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide
CID 62490976
N-(3-aminophenyl)-4-(6-oxopyrimidin-1-yl)butanamide
CID 63767929
N-(3-aminophenyl)-3-(2-methylpiperidin-1-yl)propanamide
CID 16778633
4-(2-amino-2-oxoethyl)sulfanyl-N-(3-aminophenyl)butanamide
CID 114231287

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide (CID 63172233) is N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide is Cc1cccn(CCC(=O)Nc2cccc(N)c2)c1=O.
What is the InChIKey of N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide?
The InChIKey is UPUMTUPTHHFNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-11-4-3-8-18(15(11)20)9-7-14(19)17-13-6-2-5-12(16)10-13/h2-6,8,10H,7,9,16H2,1H3,(H,17,19).
What are the key properties of N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide?
N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide has a molecular weight of 271.32 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 63172233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).