3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine

C12H16FN — CID 130045679

IUPAC3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine
SMILESCc1c(F)cccc1C1CCC(N)C1
InChIInChI=1S/C12H16FN/c1-8-11(3-2-4-12(8)13)9-5-6-10(14)7-9/h2-4,9-10H,5-7,14H2,1H3
InChIKeyKLRPPJHPHIUOQL-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.73
Rot. Bonds1

About 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine

3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine (PubChem CID 130045679) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine
PubChem CID130045679
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine
SMILESCc1c(F)cccc1C1CCC(N)C1
InChIInChI=1S/C12H16FN/c1-8-11(3-2-4-12(8)13)9-5-6-10(14)7-9/h2-4,9-10H,5-7,14H2,1H3
InChIKeyKLRPPJHPHIUOQL-UHFFFAOYSA-N
XLogP2.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-aminocyclopentyl)-2-methylaniline
CID 130045674
3-(2-fluorophenyl)cyclohexan-1-amine
CID 64503186
cis-(1R,3S)-3-(2-chlorophenyl)cyclopentan-1-amine
CID 94680134
3-(3-fluoro-2-methylphenoxy)cyclobutan-1-amine
CID 67812957
(2R)-2-(3-fluoro-2-methylphenyl)aziridine
CID 55263754
1-N-(3-fluoro-2-methylphenyl)cyclohexane-1,3-diamine
CID 79458310
3-(7-fluoro-1-benzofuran-2-yl)cyclopentan-1-amine
CID 114733255
3-[2-(trifluoromethoxy)phenyl]cyclopentan-1-amine
CID 64505049
[3-(2-fluorophenyl)cyclopentyl]methanamine
CID 82281650
3-(4-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 66030987
trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
CID 94827218
2-(3-aminocyclopentyl)-5-chlorophenol
CID 130045818

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine?
The IUPAC name of 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine (CID 130045679) is 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine?
The canonical SMILES for 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine is Cc1c(F)cccc1C1CCC(N)C1.
What is the InChIKey of 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine?
The InChIKey is KLRPPJHPHIUOQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-8-11(3-2-4-12(8)13)9-5-6-10(14)7-9/h2-4,9-10H,5-7,14H2,1H3.
What are the key properties of 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine?
3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine has a molecular weight of 193.27 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-2-methylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 130045679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).