N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide

C12H16N2O2 — CID 23633109

IUPACN-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1c[nH]ccc1=O
InChIInChI=1S/C12H16N2O2/c15-11-6-7-13-8-10(11)12(16)14-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,13,15)(H,14,16)
InChIKeyWWOLCXBSFXZUGX-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.44
Rot. Bonds2

About N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide

N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 23633109) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID23633109
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1c[nH]ccc1=O
InChIInChI=1S/C12H16N2O2/c15-11-6-7-13-8-10(11)12(16)14-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,13,15)(H,14,16)
InChIKeyWWOLCXBSFXZUGX-UHFFFAOYSA-N
XLogP1.44
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide (CID 23633109) is N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide is O=C(NC1CCCCC1)c1c[nH]ccc1=O.
What is the InChIKey of N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WWOLCXBSFXZUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-11-6-7-13-8-10(11)12(16)14-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,13,15)(H,14,16).
What are the key properties of N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide?
N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 23633109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).