3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine

C12H15F2N — CID 64910050

IUPAC3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine
SMILESCC1C(N)CCC1c1c(F)cccc1F
InChIInChI=1S/C12H15F2N/c1-7-8(5-6-11(7)15)12-9(13)3-2-4-10(12)14/h2-4,7-8,11H,5-6,15H2,1H3
InChIKeyDMBROZVUQKWXEN-UHFFFAOYSA-N
MW211.25 g/mol
LogP2.81
Rot. Bonds1

About 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine

3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine (PubChem CID 64910050) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine
PubChem CID64910050
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine
SMILESCC1C(N)CCC1c1c(F)cccc1F
InChIInChI=1S/C12H15F2N/c1-7-8(5-6-11(7)15)12-9(13)3-2-4-10(12)14/h2-4,7-8,11H,5-6,15H2,1H3
InChIKeyDMBROZVUQKWXEN-UHFFFAOYSA-N
XLogP2.81
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,6-difluorophenyl)cyclobutan-1-amine
CID 81014368
3-(2,6-difluorophenyl)-N,2-dimethylcyclopentan-1-amine
CID 64908109
2-[(2,6-difluorophenyl)methyl]cyclobutan-1-amine
CID 114935142
2-(2,6-difluoro-3-methylphenyl)cyclobutan-1-amine
CID 82827536
1-(2-bromo-6-fluorophenyl)-2,3-dimethylpiperidin-4-amine
CID 107600628
2-methyl-3-naphthalen-2-ylcyclopentan-1-amine
CID 64909840
2-[(2-chloro-6-fluorophenyl)methyl]cyclobutan-1-amine
CID 81014810
(1R)-1-[(1R,2S)-2-(2,6-difluorophenyl)cyclopropyl]ethanamine
CID 29079485
7-fluoro-2,3-dihydro-1H-inden-1-amine
CID 58440160
(1S)-7-fluoro-1-methyl-2,3-dihydro-1H-indene
CID 89205877
2-(2,6-difluorophenyl)cyclopentane-1-carboxylic acid
CID 81008993
3-(2,3-difluorophenyl)-2-methylcyclopentan-1-ol
CID 64908800

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine?
The IUPAC name of 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine (CID 64910050) is 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine.
What is the SMILES notation for 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine?
The canonical SMILES for 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine is CC1C(N)CCC1c1c(F)cccc1F.
What is the InChIKey of 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine?
The InChIKey is DMBROZVUQKWXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2N/c1-7-8(5-6-11(7)15)12-9(13)3-2-4-10(12)14/h2-4,7-8,11H,5-6,15H2,1H3.
What are the key properties of 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine?
3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine has a molecular weight of 211.25 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-difluorophenyl)-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64910050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).