N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide

C16H24N4O2 — CID 110749250

IUPACN-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCN(c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C16H24N4O2/c21-15-7-6-14(12-17-15)19-8-10-20(11-9-19)16(22)18-13-4-2-1-3-5-13/h6-7,12-13H,1-5,8-11H2,(H,17,21)(H,18,22)
InChIKeyOIHPSTSTKFVFPJ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.54
Rot. Bonds2

About N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide

N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide (PubChem CID 110749250) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide
PubChem CID110749250
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCN(c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C16H24N4O2/c21-15-7-6-14(12-17-15)19-8-10-20(11-9-19)16(22)18-13-4-2-1-3-5-13/h6-7,12-13H,1-5,8-11H2,(H,17,21)(H,18,22)
InChIKeyOIHPSTSTKFVFPJ-UHFFFAOYSA-N
XLogP1.54
TPSA68.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 4169539
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CID 858165
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CID 2932747
4-(4-aminophenyl)-N-cyclobutylpiperazine-1-carboxamide
CID 116653618
N-cyclopropyl-4-(4-fluorophenyl)piperazine-1-carboxamide
CID 47127339
methyl 4-[4-(cyclopentylcarbamoyl)piperazin-1-yl]benzoate
CID 113104537
N-cycloheptyl-4-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 113110605
4-(3-chloro-4-methylphenyl)-N-cyclopentylpiperazine-1-carboxamide
CID 113104516
N-cyclohexyl-4-(2-methylidene-3H-1,3-benzoxazol-6-yl)piperazine-1-carboxamide
CID 167642655
N-cyclohexyl-4-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)piperazine-1-carboxamide
CID 110640760
N-cycloheptyl-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108990409
N-cycloheptylpiperidine-1-carboxamide
CID 54054704

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide (CID 110749250) is N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide is O=C(NC1CCCCC1)N1CCN(c2ccc(=O)[nH]c2)CC1.
What is the InChIKey of N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide?
The InChIKey is OIHPSTSTKFVFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c21-15-7-6-14(12-17-15)19-8-10-20(11-9-19)16(22)18-13-4-2-1-3-5-13/h6-7,12-13H,1-5,8-11H2,(H,17,21)(H,18,22).
What are the key properties of N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide?
N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide is sourced from PubChem (CID 110749250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).