3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide

C14H19FN2O — CID 81350102

IUPAC3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
SMILESC[C@@H](NC(=O)C1CCC(N)C1)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c1-9(10-2-5-12(15)6-3-10)17-14(18)11-4-7-13(16)8-11/h2-3,5-6,9,11,13H,4,7-8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1
InChIKeyOGFLDGYPMVMHII-CBZQXFMTSA-N
MW250.32 g/mol
LogP2.13
Rot. Bonds3

About 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 81350102) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID81350102
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
SMILESC[C@@H](NC(=O)C1CCC(N)C1)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c1-9(10-2-5-12(15)6-3-10)17-14(18)11-4-7-13(16)8-11/h2-3,5-6,9,11,13H,4,7-8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1
InChIKeyOGFLDGYPMVMHII-CBZQXFMTSA-N
XLogP2.13
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81349509
3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 66008581
3-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81365977
3-amino-N-[cyclobutyl-(4-fluorophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119775064
3-amino-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide
CID 106212734
N-[1-(4-fluorophenyl)ethyl]cyclohexanecarboxamide
CID 46763137
3-[1-(4-fluorophenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63783147
3-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 66010445
4-amino-N-[1-(4-fluorophenyl)-2-methylpropyl]cyclohexane-1-carboxamide
CID 60848343
3-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119686806
[4-[1-(4-fluorophenyl)ethylcarbamoyl]cyclohexyl]carbamic acid
CID 67223877
3-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670664

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide (CID 81350102) is 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide is C[C@@H](NC(=O)C1CCC(N)C1)c1ccc(F)cc1.
What is the InChIKey of 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is OGFLDGYPMVMHII-CBZQXFMTSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-9(10-2-5-12(15)6-3-10)17-14(18)11-4-7-13(16)8-11/h2-3,5-6,9,11,13H,4,7-8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1.
What are the key properties of 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 250.32 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 81350102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).