N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide

C22H31NO — CID 3231412

IUPACN,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide
SMILESO=C(N(C1CCCCC1)C1CCCCC1)C1(c2ccccc2)CC1
InChIInChI=1S/C22H31NO/c24-21(22(16-17-22)18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1,4-5,10-11,19-20H,2-3,6-9,12-17H2
InChIKeyXSUHEUGQRVGQFI-UHFFFAOYSA-N
MW325.50 g/mol
LogP5.21
Rot. Bonds4

About N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide

N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide (PubChem CID 3231412) has the molecular formula C22H31NO and a molecular weight of 325.50 g/mol. Its IUPAC name is N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide
PubChem CID3231412
Molecular FormulaC22H31NO
Molecular Weight325.50 g/mol
Exact Mass325.24
IUPAC NameN,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide
SMILESO=C(N(C1CCCCC1)C1CCCCC1)C1(c2ccccc2)CC1
InChIInChI=1S/C22H31NO/c24-21(22(16-17-22)18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1,4-5,10-11,19-20H,2-3,6-9,12-17H2
InChIKeyXSUHEUGQRVGQFI-UHFFFAOYSA-N
XLogP5.21
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.50
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N-dicyclohexyl-1-phenylcyclopropane-1-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-(2-hydroxycyclohexyl)-N-methyl-1-phenylcyclopropane-1-carboxamide
CID 102634188
N-cyclobutyl-N-(2-hydroxyethyl)-1-phenylcyclopentane-1-carboxamide
CID 102867305
cyclopentyl-(1-phenylcyclopropyl)methanone
CID 63080026
N-cyclopropyl-N-(2-hydroxyethyl)-1-phenylcyclopropane-1-carboxamide
CID 43577241
1-(4-aminophenyl)-N-cyclohexyl-N-ethylcyclopropane-1-carboxamide
CID 115913190
4-N,4-N-dicyclohexyl-1-N-(1-phenylcyclopropyl)benzene-1,4-dicarboxamide
CID 3923780
1-(4-chlorophenyl)-N-cycloheptyl-N-methylcyclopropane-1-carboxamide
CID 55468765
1-(4-aminophenyl)-N-cyclohexyl-N-methylcyclopropane-1-carboxamide
CID 115913184
1-(4-bromophenyl)-N-cycloheptyl-N-methylcyclopropane-1-carboxamide
CID 55521341
N-cyclopropyl-N-(2-hydroxyethyl)-1-phenylcyclopentane-1-carboxamide
CID 43576656
1-amino-N,N-dicyclohexylcyclopropane-1-carboxamide
CID 65465472
N-methyl-1-phenylcyclopropane-1-carbohydrazide
CID 116846008

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide (CID 3231412) is N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide is O=C(N(C1CCCCC1)C1CCCCC1)C1(c2ccccc2)CC1.
What is the InChIKey of N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide?
The InChIKey is XSUHEUGQRVGQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NO/c24-21(22(16-17-22)18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1,4-5,10-11,19-20H,2-3,6-9,12-17H2.
What are the key properties of N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide?
N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide has a molecular weight of 325.50 g/mol, XLogP of 5.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 3231412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).