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

C14H19FN2O — CID 66008581

IUPAC3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCC(N)C1)c1cccc(F)c1
InChIInChI=1S/C14H19FN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18)
InChIKeyFGHQTELFUIGRBF-UHFFFAOYSA-N
MW250.32 g/mol
LogP2.13
Rot. Bonds3

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

3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 66008581) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID66008581
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCC(N)C1)c1cccc(F)c1
InChIInChI=1S/C14H19FN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18)
InChIKeyFGHQTELFUIGRBF-UHFFFAOYSA-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-[(1S)-1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81365977
N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
CID 60630491
3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
CID 81376252
3-amino-N-[1-[3-(trifluoromethyl)phenyl]ethyl]cyclopentane-1-carboxamide
CID 66009151
3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81350102
4-(aminomethyl)-N-[1-(3-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 79526822
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106740405
N-[1-(3-fluorophenyl)ethyl]pyrrolidine-3-carboxamide
CID 63005470
3-amino-N-[1-(3-pyrazol-1-ylphenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119788707
3-amino-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119863798
2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81365382
1-acetyl-N-[1-(3-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 42907119

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide (CID 66008581) is 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide is CC(NC(=O)C1CCC(N)C1)c1cccc(F)c1.
What is the InChIKey of 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is FGHQTELFUIGRBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18).
What are the key properties of 3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[1-(3-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-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 66008581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).