1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide

C17H21N3O2 — CID 125441292

IUPAC1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide
SMILESCC[C@H](NC(=O)c1ccc(C)n(CC)c1=O)c1cccnc1
InChIInChI=1S/C17H21N3O2/c1-4-15(13-7-6-10-18-11-13)19-16(21)14-9-8-12(3)20(5-2)17(14)22/h6-11,15H,4-5H2,1-3H3,(H,19,21)/t15-/m0/s1
InChIKeyOBRATZGOXRCFPL-HNNXBMFYSA-N
MW299.37 g/mol
LogP2.45
Rot. Bonds5

About 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide

1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide (PubChem CID 125441292) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide
PubChem CID125441292
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide
SMILESCC[C@H](NC(=O)c1ccc(C)n(CC)c1=O)c1cccnc1
InChIInChI=1S/C17H21N3O2/c1-4-15(13-7-6-10-18-11-13)19-16(21)14-9-8-12(3)20(5-2)17(14)22/h6-11,15H,4-5H2,1-3H3,(H,19,21)/t15-/m0/s1
InChIKeyOBRATZGOXRCFPL-HNNXBMFYSA-N
XLogP2.45
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,6-dimethyl-2-oxo-1-pyridinyl)-N-[(1S)-1-pyridin-3-ylpropyl]acetamide
CID 59951658
1-ethyl-6-methyl-2-oxo-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyridine-3-carboxamide
CID 99929015
1,6-dimethyl-2-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridine-3-carboxamide
CID 125437332
3-fluoro-4-methyl-N-(1-pyridin-3-ylpropyl)benzamide
CID 91796729
1,2,5-trimethyl-N-(3-methyl-1-pyridin-3-ylbutyl)pyrrole-3-carboxamide
CID 135106046
N-(3,3-dimethyl-1-pyridin-3-ylbutyl)-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 131902711
N-(3,3-dimethyl-1-pyridin-3-ylbutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 122572746
1-piperidin-1-yl-N-(1-pyridin-3-ylpropyl)cyclohexane-1-carboxamide
CID 91787819
3-fluoro-N-[(1S)-1-pyridin-3-ylpentyl]pyridine-4-carboxamide
CID 125447618
2-methyl-N-(1-pyridin-4-ylpropyl)benzamide
CID 122142222
3-(1,2-oxazol-5-yl)-N-[(1S)-1-pyridin-3-ylpropyl]propanamide
CID 125441013
ethane;N-(1-pyridin-3-ylpropyl)-2-(1-pyridin-3-ylpropylamino)thieno[3,2-d]pyrimidine-4-carboxamide
CID 142540083

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide?
The IUPAC name of 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide (CID 125441292) is 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide.
What is the SMILES notation for 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide?
The canonical SMILES for 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide is CC[C@H](NC(=O)c1ccc(C)n(CC)c1=O)c1cccnc1.
What is the InChIKey of 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide?
The InChIKey is OBRATZGOXRCFPL-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-4-15(13-7-6-10-18-11-13)19-16(21)14-9-8-12(3)20(5-2)17(14)22/h6-11,15H,4-5H2,1-3H3,(H,19,21)/t15-/m0/s1.
What are the key properties of 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide?
1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methyl-2-oxo-N-[(1S)-1-pyridin-3-ylpropyl]pyridine-3-carboxamide is sourced from PubChem (CID 125441292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).