N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide

C19H27NO — CID 46891301

IUPACN-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide
SMILESCN(C(=O)C1(c2ccccc2)CCCC1)C1CCCCC1
InChIInChI=1S/C19H27NO/c1-20(17-12-6-3-7-13-17)18(21)19(14-8-9-15-19)16-10-4-2-5-11-16/h2,4-5,10-11,17H,3,6-9,12-15H2,1H3
InChIKeyPGJXJIVIRCSMBL-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.29
Rot. Bonds3

About N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide

N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide (PubChem CID 46891301) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide
PubChem CID46891301
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC NameN-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide
SMILESCN(C(=O)C1(c2ccccc2)CCCC1)C1CCCCC1
InChIInChI=1S/C19H27NO/c1-20(17-12-6-3-7-13-17)18(21)19(14-8-9-15-19)16-10-4-2-5-11-16/h2,4-5,10-11,17H,3,6-9,12-15H2,1H3
InChIKeyPGJXJIVIRCSMBL-UHFFFAOYSA-N
XLogP4.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide (CID 46891301) is N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide is CN(C(=O)C1(c2ccccc2)CCCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide?
The InChIKey is PGJXJIVIRCSMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-20(17-12-6-3-7-13-17)18(21)19(14-8-9-15-19)16-10-4-2-5-11-16/h2,4-5,10-11,17H,3,6-9,12-15H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide?
N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide has a molecular weight of 285.43 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 46891301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).