(2-fluorophenyl)-(2-methylcyclopentyl)methanamine

C13H18FN — CID 107188100

IUPAC(2-fluorophenyl)-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1C(N)c1ccccc1F
InChIInChI=1S/C13H18FN/c1-9-5-4-7-10(9)13(15)11-6-2-3-8-12(11)14/h2-3,6,8-10,13H,4-5,7,15H2,1H3
InChIKeyHGYPBFUUFQWNIC-UHFFFAOYSA-N
MW207.29 g/mol
LogP3.26
Rot. Bonds2

About (2-fluorophenyl)-(2-methylcyclopentyl)methanamine

(2-fluorophenyl)-(2-methylcyclopentyl)methanamine (PubChem CID 107188100) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is (2-fluorophenyl)-(2-methylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2-fluorophenyl)-(2-methylcyclopentyl)methanamine
PubChem CID107188100
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name(2-fluorophenyl)-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1C(N)c1ccccc1F
InChIInChI=1S/C13H18FN/c1-9-5-4-7-10(9)13(15)11-6-2-3-8-12(11)14/h2-3,6,8-10,13H,4-5,7,15H2,1H3
InChIKeyHGYPBFUUFQWNIC-UHFFFAOYSA-N
XLogP3.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,4-difluorophenyl)-(2-methylcyclopentyl)methanamine
CID 107177000
(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107177071
(2-fluoro-4,5-dimethoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107177787
(4-methoxynaphthalen-1-yl)-(2-methylcyclopentyl)methanamine
CID 107177081
2-(2-fluorophenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107179552
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107178298
(2-fluorophenyl)-(oxan-4-yl)methanamine
CID 63934888
(2-fluorophenyl)-(thian-4-yl)methanamine
CID 82391625
3-bicyclo[3.1.0]hexanyl-(2-fluorophenyl)methanamine
CID 115828090
2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine
CID 65409529
N'-cyclohexyl-1-(2-fluorophenyl)-N'-methylethane-1,2-diamine
CID 16786425
1-benzofuran-2-yl-(2-methylcyclopentyl)methanamine
CID 107191076

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(2-methylcyclopentyl)methanamine?
The IUPAC name of (2-fluorophenyl)-(2-methylcyclopentyl)methanamine (CID 107188100) is (2-fluorophenyl)-(2-methylcyclopentyl)methanamine.
What is the SMILES notation for (2-fluorophenyl)-(2-methylcyclopentyl)methanamine?
The canonical SMILES for (2-fluorophenyl)-(2-methylcyclopentyl)methanamine is CC1CCCC1C(N)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-(2-methylcyclopentyl)methanamine?
The InChIKey is HGYPBFUUFQWNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-9-5-4-7-10(9)13(15)11-6-2-3-8-12(11)14/h2-3,6,8-10,13H,4-5,7,15H2,1H3.
What are the key properties of (2-fluorophenyl)-(2-methylcyclopentyl)methanamine?
(2-fluorophenyl)-(2-methylcyclopentyl)methanamine has a molecular weight of 207.29 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(2-methylcyclopentyl)methanamine is sourced from PubChem (CID 107188100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).