3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide

C18H26N2O — CID 119698154

IUPAC3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCC2(c3ccccc3)CCCC2)C1
InChIInChI=1S/C18H26N2O/c19-16-9-8-14(12-16)17(21)20-13-18(10-4-5-11-18)15-6-2-1-3-7-15/h1-3,6-7,14,16H,4-5,8-13,19H2,(H,20,21)
InChIKeyZLYKGVZHVFRNDZ-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.74
Rot. Bonds4

About 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide

3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide (PubChem CID 119698154) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide
PubChem CID119698154
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCC2(c3ccccc3)CCCC2)C1
InChIInChI=1S/C18H26N2O/c19-16-9-8-14(12-16)17(21)20-13-18(10-4-5-11-18)15-6-2-1-3-7-15/h1-3,6-7,14,16H,4-5,8-13,19H2,(H,20,21)
InChIKeyZLYKGVZHVFRNDZ-UHFFFAOYSA-N
XLogP2.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[(4-phenyloxan-4-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119731085
3-amino-N-[[1-(2,6-difluorophenyl)cyclopentyl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119765192
N-[(1-phenylcyclopentyl)methyl]cyclohexanecarboxamide
CID 18128273
(1S,3R,4R)-3-amino-4-hydroxy-N-[(1-phenylcyclohexyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 155940030
N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
CID 119275845
N-[(1-phenylcyclohexyl)methyl]oxane-4-carboxamide
CID 51078296
3-amino-N-[[1-(2-bromophenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
CID 119800146
(3S)-N-[(1-phenylcyclopentyl)methyl]oxolane-3-carboxamide
CID 95272452
3-amino-N-[(1-phenylcyclopentyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119698155
3-amino-N-[[1-(3-bromophenyl)cyclopropyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119786274
3-amino-N-[[1-(3-fluorophenyl)cyclopropyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119799668
3-amino-N-[[4-(3-chlorophenyl)oxan-4-yl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119749889

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide (CID 119698154) is 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide is NC1CCC(C(=O)NCC2(c3ccccc3)CCCC2)C1.
What is the InChIKey of 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is ZLYKGVZHVFRNDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c19-16-9-8-14(12-16)17(21)20-13-18(10-4-5-11-18)15-6-2-1-3-7-15/h1-3,6-7,14,16H,4-5,8-13,19H2,(H,20,21).
What are the key properties of 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide?
3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119698154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).