N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide

C18H23N3O2 — CID 47796916

IUPACN-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)C2CC=CCC2)CC1)c1cccnc1
InChIInChI=1S/C18H23N3O2/c22-17(15-7-4-10-19-13-15)20-16-8-11-21(12-9-16)18(23)14-5-2-1-3-6-14/h1-2,4,7,10,13-14,16H,3,5-6,8-9,11-12H2,(H,20,22)
InChIKeyJNLPXXGTIXOQHN-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.16
Rot. Bonds3

About N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide

N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 47796916) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
PubChem CID47796916
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)C2CC=CCC2)CC1)c1cccnc1
InChIInChI=1S/C18H23N3O2/c22-17(15-7-4-10-19-13-15)20-16-8-11-21(12-9-16)18(23)14-5-2-1-3-6-14/h1-2,4,7,10,13-14,16H,3,5-6,8-9,11-12H2,(H,20,22)
InChIKeyJNLPXXGTIXOQHN-UHFFFAOYSA-N
XLogP2.16
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentylpyridine-3-carboxamide
CID 805532
N-[1-(2-chlorobenzoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797182
N-[1-(4-butylcyclohexanecarbonyl)piperidin-4-yl]pyridine-3-carboxamide
CID 60591003
phenyl 4-(pyridine-3-carbonylamino)piperidine-1-carboxylate
CID 110821885
N-[1-(2,3-dihydro-1-benzofuran-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47796963
N-[1-(3-methylbutanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797205
N-(1-methylsulfonylpiperidin-4-yl)pyridine-3-carboxamide
CID 3218770
N-[1-(butylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 127165622
N-[1-(benzylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47836760
N-[1-(2-cyclohexylideneacetyl)piperidin-4-yl]pyridine-3-carboxamide
CID 108924958
N-[1-(4-pyrrol-1-ylbenzoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47796919
N-[1-(4-cyclohexylbutanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47076419

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide (CID 47796916) is N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide is O=C(NC1CCN(C(=O)C2CC=CCC2)CC1)c1cccnc1.
What is the InChIKey of N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is JNLPXXGTIXOQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c22-17(15-7-4-10-19-13-15)20-16-8-11-21(12-9-16)18(23)14-5-2-1-3-6-14/h1-2,4,7,10,13-14,16H,3,5-6,8-9,11-12H2,(H,20,22).
What are the key properties of N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 47796916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).