1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide

C18H27N3O — CID 119448297

IUPAC1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide
SMILESO=C(NCCN1CCNCC1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H27N3O/c22-17(20-12-15-21-13-10-19-11-14-21)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7,19H,4-5,8-15H2,(H,20,22)
InChIKeyRXMWXZKKVMKPKO-UHFFFAOYSA-N
MW301.43 g/mol
LogP1.52
Rot. Bonds5

About 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide

1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide (PubChem CID 119448297) has the molecular formula C18H27N3O and a molecular weight of 301.43 g/mol. Its IUPAC name is 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide
PubChem CID119448297
Molecular FormulaC18H27N3O
Molecular Weight301.43 g/mol
Exact Mass301.22
IUPAC Name1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide
SMILESO=C(NCCN1CCNCC1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H27N3O/c22-17(20-12-15-21-13-10-19-11-14-21)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7,19H,4-5,8-15H2,(H,20,22)
InChIKeyRXMWXZKKVMKPKO-UHFFFAOYSA-N
XLogP1.52
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-N-(3-piperazin-1-ylpropyl)cyclopentane-1-carboxamide
CID 119393727
1-(3-bromophenyl)-N-(2-piperazin-1-ylethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119447484
1-(3-methylphenyl)-N-(3-piperazin-1-ylpropyl)cyclohexane-1-carboxamide;hydrochloride
CID 119393940
1-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)cyclopropane-1-carboxamide
CID 119394382
1-phenyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopropane-1-carboxamide
CID 55992757
N-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]-1-(4-chlorophenyl)cyclopentane-1-carboxamide
CID 29195577
N-(3-amino-3-oxopropyl)-1-phenylcyclopentane-1-carboxamide
CID 110473789
N-(3,3-dimethylbutyl)-4-phenylpiperidine-4-carboxamide
CID 115597355
(1-phenylcyclobutyl)-piperazin-1-ylmethanone
CID 110463899
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
N-(2-aminoethyl)-1-phenylcyclobutane-1-carboxamide;hydrochloride
CID 119383117
4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide
CID 70118904

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide (CID 119448297) is 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide is O=C(NCCN1CCNCC1)C1(c2ccccc2)CCCC1.
What is the InChIKey of 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide?
The InChIKey is RXMWXZKKVMKPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O/c22-17(20-12-15-21-13-10-19-11-14-21)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7,19H,4-5,8-15H2,(H,20,22).
What are the key properties of 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide?
1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide has a molecular weight of 301.43 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119448297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).