N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide

C16H17N3O2 — CID 134351059

IUPACN-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide
SMILESCc1ncccc1NC(=O)C(C)NC(=O)c1ccccc1
InChIInChI=1S/C16H17N3O2/c1-11-14(9-6-10-17-11)19-15(20)12(2)18-16(21)13-7-4-3-5-8-13/h3-10,12H,1-2H3,(H,18,21)(H,19,20)
InChIKeyAYEZLVFARHIIEI-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.15
Rot. Bonds4

About N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide

N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide (PubChem CID 134351059) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide
PubChem CID134351059
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide
SMILESCc1ncccc1NC(=O)C(C)NC(=O)c1ccccc1
InChIInChI=1S/C16H17N3O2/c1-11-14(9-6-10-17-11)19-15(20)12(2)18-16(21)13-7-4-3-5-8-13/h3-10,12H,1-2H3,(H,18,21)(H,19,20)
InChIKeyAYEZLVFARHIIEI-UHFFFAOYSA-N
XLogP2.15
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-3-N-[(2S)-1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzene-1,3-dicarboxamide
CID 167859929
N-[1-(2-chloroanilino)-1-oxopropan-2-yl]benzamide
CID 46756229
N-[(2S)-1-[(4-methyl-2-pyridinyl)amino]-1-oxopropan-2-yl]benzamide
CID 41083862
2-chloro-N-(2-methyl-3-pyridinyl)-2-phenylacetamide
CID 79041942
N-[1-[2-methyl-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl]benzamide
CID 134351074
N-[1-(2-fluoroanilino)-1-oxopropan-2-yl]-2,3-dimethylquinoxaline-6-carboxamide
CID 110407656
N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]benzamide
CID 42909871
N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 68732786
2-methyl-N-(2-methyl-3-pyridinyl)benzamide
CID 71985815
(2S)-2-amino-N-(2-methyl-3-pyridinyl)-3-phenylpropanamide
CID 54173969
N-[1-(2,4-difluoroanilino)-1-oxopropan-2-yl]benzamide
CID 18160924
4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
CID 79041653

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide?
The IUPAC name of N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide (CID 134351059) is N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide?
The canonical SMILES for N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide is Cc1ncccc1NC(=O)C(C)NC(=O)c1ccccc1.
What is the InChIKey of N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide?
The InChIKey is AYEZLVFARHIIEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-11-14(9-6-10-17-11)19-15(20)12(2)18-16(21)13-7-4-3-5-8-13/h3-10,12H,1-2H3,(H,18,21)(H,19,20).
What are the key properties of N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide?
N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide has a molecular weight of 283.33 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-methyl-3-pyridinyl)amino]-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 134351059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).