N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide

C16H28N2O — CID 86860914

IUPACN-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESC=C(C)CN1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C16H28N2O/c1-13(2)12-18-10-8-15(9-11-18)17-16(19)14-6-4-3-5-7-14/h14-15H,1,3-12H2,2H3,(H,17,19)
InChIKeyKZIKPOMTEXIJCQ-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.72
Rot. Bonds4

About N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide

N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 86860914) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide
PubChem CID86860914
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESC=C(C)CN1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C16H28N2O/c1-13(2)12-18-10-8-15(9-11-18)17-16(19)14-6-4-3-5-7-14/h14-15H,1,3-12H2,2H3,(H,17,19)
InChIKeyKZIKPOMTEXIJCQ-UHFFFAOYSA-N
XLogP2.72
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide 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-[1-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 86860953
N-[1-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]piperidin-4-yl]cycloheptanecarboxamide
CID 57443202
N-cyclopropylcyclohexanecarboxamide
CID 3412875
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclohexanecarboxamide
CID 3220728
4-(cyclohexanecarbonylamino)-N-cyclohexylpiperidine-1-carboxamide
CID 3218389
N-[1-[2-(2,3-dimethylanilino)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 3220746
N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 165434516
N-[1-(2-ethylbutanoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 60550291
N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide
CID 99775471

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide (CID 86860914) is N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide is C=C(C)CN1CCC(NC(=O)C2CCCCC2)CC1.
What is the InChIKey of N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is KZIKPOMTEXIJCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-13(2)12-18-10-8-15(9-11-18)17-16(19)14-6-4-3-5-7-14/h14-15H,1,3-12H2,2H3,(H,17,19).
What are the key properties of N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide?
N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 264.41 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 86860914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).