cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide

C18H20N2O — CID 56906171

IUPACcis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
SMILESN[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3ccccc3)c2)C1
InChIInChI=1S/C18H20N2O/c19-16-10-9-15(11-16)18(21)20-17-8-4-7-14(12-17)13-5-2-1-3-6-13/h1-8,12,15-16H,9-11,19H2,(H,20,21)/t15-,16+/m0/s1
InChIKeyVFGFQPKGODDMGE-JKSUJKDBSA-N
MW280.37 g/mol
LogP3.42
Rot. Bonds3

About cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide

cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide (PubChem CID 56906171) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
PubChem CID56906171
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Namecis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
SMILESN[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3ccccc3)c2)C1
InChIInChI=1S/C18H20N2O/c19-16-10-9-15(11-16)18(21)20-17-8-4-7-14(12-17)13-5-2-1-3-6-13/h1-8,12,15-16H,9-11,19H2,(H,20,21)/t15-,16+/m0/s1
InChIKeyVFGFQPKGODDMGE-JKSUJKDBSA-N
XLogP3.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 66010193
3-amino-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]cyclopentane-1-carboxamide
CID 119699623
3-amino-N-[3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
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3-amino-N-[3-(1,3-dioxolan-2-yl)phenyl]cyclopentane-1-carboxamide
CID 106911930
3-amino-N-[3-[methyl(phenyl)sulfamoyl]phenyl]cyclopentane-1-carboxamide
CID 119676593
3-amino-N-(2-phenylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119675324
3-amino-N-[3-(difluoromethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119707736
N-[3-[(3-aminocyclohexanecarbonyl)amino]phenyl]benzamide;hydrochloride
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3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide
CID 119673239
3-amino-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
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CID 79462712

Frequently Asked Questions

What is the IUPAC name of cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide (CID 56906171) is cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide is N[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3ccccc3)c2)C1.
What is the InChIKey of cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide?
The InChIKey is VFGFQPKGODDMGE-JKSUJKDBSA-N. The full InChI is InChI=1S/C18H20N2O/c19-16-10-9-15(11-16)18(21)20-17-8-4-7-14(12-17)13-5-2-1-3-6-13/h1-8,12,15-16H,9-11,19H2,(H,20,21)/t15-,16+/m0/s1.
What are the key properties of cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide?
cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 56906171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).