N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide

C18H26N2O — CID 120555936

IUPACN-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide
SMILESCC1CNCCC1NC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O/c1-14-13-19-12-9-16(14)20-17(21)18(10-5-6-11-18)15-7-3-2-4-8-15/h2-4,7-8,14,16,19H,5-6,9-13H2,1H3,(H,20,21)
InChIKeyJODZAPRMMIJOPF-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.61
Rot. Bonds3

About N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide

N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide (PubChem CID 120555936) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide
PubChem CID120555936
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide
SMILESCC1CNCCC1NC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O/c1-14-13-19-12-9-16(14)20-17(21)18(10-5-6-11-18)15-7-3-2-4-8-15/h2-4,7-8,14,16,19H,5-6,9-13H2,1H3,(H,20,21)
InChIKeyJODZAPRMMIJOPF-UHFFFAOYSA-N
XLogP2.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylpiperidin-4-yl)-1-phenylcyclopropane-1-carboxamide
CID 120555297
1-(4-chlorophenyl)-N-(3-methylpiperidin-4-yl)cyclopentane-1-carboxamide
CID 120553378
1-(4-bromophenyl)-N-(3-methylpiperidin-4-yl)cyclopentane-1-carboxamide
CID 120553584
1-(4-bromophenyl)-N-(3-methylpiperidin-4-yl)cyclopentane-1-carboxamide;hydrochloride
CID 120553583
1-(4-chlorophenyl)-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide;hydrochloride
CID 120557919
1-(3-fluorophenyl)-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 120556704
N-(3-methylpiperidin-4-yl)-1-[3-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide
CID 120554712
1-(4-fluorophenyl)-N-(3-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120556663
1-(3-bromophenyl)-N-(3-methylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 120555475
1-(3,4-dichlorophenyl)-N-(3-methylpiperidin-4-yl)cyclobutane-1-carboxamide
CID 120555393
1-methyl-N-(3-methylpiperidin-4-yl)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 120557540
N-(2-methylpiperidin-3-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
CID 120577312

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide (CID 120555936) is N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide is CC1CNCCC1NC(=O)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide?
The InChIKey is JODZAPRMMIJOPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-14-13-19-12-9-16(14)20-17(21)18(10-5-6-11-18)15-7-3-2-4-8-15/h2-4,7-8,14,16,19H,5-6,9-13H2,1H3,(H,20,21).
What are the key properties of N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide?
N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 120555936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).