N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide

C15H22N2O2 — CID 103765034

IUPACN-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCCC(NC(=O)c1cc[nH]c(=O)c1)C1CCCCC1
InChIInChI=1S/C15H22N2O2/c1-2-13(11-6-4-3-5-7-11)17-15(19)12-8-9-16-14(18)10-12/h8-11,13H,2-7H2,1H3,(H,16,18)(H,17,19)
InChIKeyXPUJBYSZACTQFQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.46
Rot. Bonds4

About N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide

N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103765034) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103765034
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCCC(NC(=O)c1cc[nH]c(=O)c1)C1CCCCC1
InChIInChI=1S/C15H22N2O2/c1-2-13(11-6-4-3-5-7-11)17-15(19)12-8-9-16-14(18)10-12/h8-11,13H,2-7H2,1H3,(H,16,18)(H,17,19)
InChIKeyXPUJBYSZACTQFQ-UHFFFAOYSA-N
XLogP2.46
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide (CID 103765034) is N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide is CCC(NC(=O)c1cc[nH]c(=O)c1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is XPUJBYSZACTQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-13(11-6-4-3-5-7-11)17-15(19)12-8-9-16-14(18)10-12/h8-11,13H,2-7H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide?
N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103765034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).