4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

C21H32N2O — CID 24776413

IUPAC4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC(C)C1CCC(N2CCC(C(N)=O)(c3ccccc3)CC2)CC1
InChIInChI=1S/C21H32N2O/c1-16(2)17-8-10-19(11-9-17)23-14-12-21(13-15-23,20(22)24)18-6-4-3-5-7-18/h3-7,16-17,19H,8-15H2,1-2H3,(H2,22,24)
InChIKeyVDYFCXBEFJDRLQ-UHFFFAOYSA-N
MW328.50 g/mol
LogP3.72
Rot. Bonds4

About 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (PubChem CID 24776413) has the molecular formula C21H32N2O and a molecular weight of 328.50 g/mol. Its IUPAC name is 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
PubChem CID24776413
Molecular FormulaC21H32N2O
Molecular Weight328.50 g/mol
Exact Mass328.25
IUPAC Name4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC(C)C1CCC(N2CCC(C(N)=O)(c3ccccc3)CC2)CC1
InChIInChI=1S/C21H32N2O/c1-16(2)17-8-10-19(11-9-17)23-14-12-21(13-15-23,20(22)24)18-6-4-3-5-7-18/h3-7,16-17,19H,8-15H2,1-2H3,(H2,22,24)
InChIKeyVDYFCXBEFJDRLQ-UHFFFAOYSA-N
XLogP3.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.50
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Isopropamide
CID 3775
Isopropamide Iodide
CID 6284
Phenglutarimide
CID 102669
Fenpiverinium Bromide
CID 71489
Sameridine
CID 65996
Norpipanone
CID 22391
Fenpiverinium
CID 71490
Dipipanone
CID 13331
Butyramide, 4-diisopropylamino-2,2-diphenyl-
CID 38310
1,5-Dimethyl-3,3-diphenylpyrrolidin-2-one
CID 207584
Aminopentamide Sulfate
CID 176163
alpha,alpha-Diphenyl-1-piperidinebutanamide
CID 65573

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (CID 24776413) is 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is CC(C)C1CCC(N2CCC(C(N)=O)(c3ccccc3)CC2)CC1.
What is the InChIKey of 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is VDYFCXBEFJDRLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O/c1-16(2)17-8-10-19(11-9-17)23-14-12-21(13-15-23,20(22)24)18-6-4-3-5-7-18/h3-7,16-17,19H,8-15H2,1-2H3,(H2,22,24).
What are the key properties of 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 328.50 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 24776413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).