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

C12H15F2N — CID 116538869

IUPAC3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine
SMILESCC1(c2cccc(F)c2F)CCC(N)C1
InChIInChI=1S/C12H15F2N/c1-12(6-5-8(15)7-12)9-3-2-4-10(13)11(9)14/h2-4,8H,5-7,15H2,1H3
InChIKeyILUQFMJYJAWYGJ-UHFFFAOYSA-N
MW211.25 g/mol
LogP2.73
Rot. Bonds1

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

3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine (PubChem CID 116538869) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine
PubChem CID116538869
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine
SMILESCC1(c2cccc(F)c2F)CCC(N)C1
InChIInChI=1S/C12H15F2N/c1-12(6-5-8(15)7-12)9-3-2-4-10(13)11(9)14/h2-4,8H,5-7,15H2,1H3
InChIKeyILUQFMJYJAWYGJ-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-3-naphthalen-1-ylcyclopentan-1-amine
CID 116538934
3-(2-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538709
3-fluoro-3-(2-fluorophenyl)cyclopentan-1-amine
CID 112565720
cis-(1R,3R)-3-methyl-3-phenylcyclopentan-1-amine;hydrochloride
CID 173470709
1-(2,3-difluorophenyl)-3-methylcyclohexan-1-amine
CID 63989623
1-(2,3-difluorophenyl)-3-methylcyclopentan-1-ol
CID 64516207
3-(furan-3-yl)-3-methylcyclopentan-1-amine
CID 116538755
1-(2,3-difluorophenyl)-2-methylcyclopropan-1-ol
CID 79332533
3-methyl-3-(4-phenylphenyl)cyclopentan-1-amine
CID 116538694
3-(2,5-dimethoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538682
3-(3-ethylphenyl)-3-methylcyclopentan-1-amine
CID 116538959
1-(2,3-difluorophenyl)cyclobutan-1-amine
CID 83412499

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine?
The IUPAC name of 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine (CID 116538869) is 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine is CC1(c2cccc(F)c2F)CCC(N)C1.
What is the InChIKey of 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine?
The InChIKey is ILUQFMJYJAWYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2N/c1-12(6-5-8(15)7-12)9-3-2-4-10(13)11(9)14/h2-4,8H,5-7,15H2,1H3.
What are the key properties of 3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine?
3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine has a molecular weight of 211.25 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-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 116538869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).