N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine

C14H20FN — CID 81351515

IUPACN-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(N[C@H](C)c2ccc(F)cc2)C1
InChIInChI=1S/C14H20FN/c1-10-3-8-14(9-10)16-11(2)12-4-6-13(15)7-5-12/h4-7,10-11,14,16H,3,8-9H2,1-2H3/t10?,11-,14?/m1/s1
InChIKeyFNDXBENXSMTDCN-IQLKVPPVSA-N
MW221.32 g/mol
LogP3.66
Rot. Bonds3

About N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine

N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine (PubChem CID 81351515) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine
PubChem CID81351515
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC NameN-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(N[C@H](C)c2ccc(F)cc2)C1
InChIInChI=1S/C14H20FN/c1-10-3-8-14(9-10)16-11(2)12-4-6-13(15)7-5-12/h4-7,10-11,14,16H,3,8-9H2,1-2H3/t10?,11-,14?/m1/s1
InChIKeyFNDXBENXSMTDCN-IQLKVPPVSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-3,5-dimethylcyclohexan-1-amine
CID 64723418
N-[(1R)-1-(4-fluorophenyl)ethyl]-3,5-dimethylcyclohexan-1-amine
CID 81348393
3-N-[(1S)-1-(4-fluorophenyl)ethyl]cyclopentane-1,3-diamine
CID 81348443
N-[(1S)-1-(3-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine
CID 81365764
N-[1-(3-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine
CID 64502479
N-[1-(4-fluorophenyl)ethyl]-3,3,5-trimethylcyclohexan-1-amine
CID 43078690
N-[(1S)-1-(4-fluorophenyl)ethyl]-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 81347756
1-(4-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
CID 107411910
1-N-[1-(4-fluorophenyl)ethyl]cyclohexane-1,3-diamine
CID 79459404
N-[1-(4-ethoxyphenyl)ethyl]-3-methylcyclopentan-1-amine
CID 64500026
3-[1-(4-fluorophenyl)ethylamino]cyclohexane-1-carboxylic acid
CID 65066345
3-[[(1R)-1-(4-fluorophenyl)ethyl]amino]cyclohexane-1-carboxylic acid
CID 104881581

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine?
The IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine (CID 81351515) is N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine is CC1CCC(N[C@H](C)c2ccc(F)cc2)C1.
What is the InChIKey of N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine?
The InChIKey is FNDXBENXSMTDCN-IQLKVPPVSA-N. The full InChI is InChI=1S/C14H20FN/c1-10-3-8-14(9-10)16-11(2)12-4-6-13(15)7-5-12/h4-7,10-11,14,16H,3,8-9H2,1-2H3/t10?,11-,14?/m1/s1.
What are the key properties of N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine?
N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine has a molecular weight of 221.32 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-fluorophenyl)ethyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 81351515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).