N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide

C13H18N2O2 — CID 14989569

IUPACN-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide
SMILESCC(=O)NC1(c2ccc(=O)[nH]c2)CCCCC1
InChIInChI=1S/C13H18N2O2/c1-10(16)15-13(7-3-2-4-8-13)11-5-6-12(17)14-9-11/h5-6,9H,2-4,7-8H2,1H3,(H,14,17)(H,15,16)
InChIKeyKKMZBMMLZKHUIV-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.67
Rot. Bonds2

About N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide

N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide (PubChem CID 14989569) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide
PubChem CID14989569
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide
SMILESCC(=O)NC1(c2ccc(=O)[nH]c2)CCCCC1
InChIInChI=1S/C13H18N2O2/c1-10(16)15-13(7-3-2-4-8-13)11-5-6-12(17)14-9-11/h5-6,9H,2-4,7-8H2,1H3,(H,14,17)(H,15,16)
InChIKeyKKMZBMMLZKHUIV-UHFFFAOYSA-N
XLogP1.67
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide?
The IUPAC name of N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide (CID 14989569) is N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide.
What is the SMILES notation for N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide?
The canonical SMILES for N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide is CC(=O)NC1(c2ccc(=O)[nH]c2)CCCCC1.
What is the InChIKey of N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide?
The InChIKey is KKMZBMMLZKHUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-10(16)15-13(7-3-2-4-8-13)11-5-6-12(17)14-9-11/h5-6,9H,2-4,7-8H2,1H3,(H,14,17)(H,15,16).
What are the key properties of N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide?
N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-oxo-1H-pyridin-3-yl)cyclohexyl]acetamide is sourced from PubChem (CID 14989569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).