1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine

C12H15F2N — CID 64516724

IUPAC1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine
SMILESCC1CCC(N)(c2cc(F)cc(F)c2)C1
InChIInChI=1S/C12H15F2N/c1-8-2-3-12(15,7-8)9-4-10(13)6-11(14)5-9/h4-6,8H,2-3,7,15H2,1H3
InChIKeyUCBUINBCKUJEJQ-UHFFFAOYSA-N
MW211.25 g/mol
LogP2.94
Rot. Bonds1

About 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine

1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine (PubChem CID 64516724) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine
PubChem CID64516724
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine
SMILESCC1CCC(N)(c2cc(F)cc(F)c2)C1
InChIInChI=1S/C12H15F2N/c1-8-2-3-12(15,7-8)9-4-10(13)6-11(14)5-9/h4-6,8H,2-3,7,15H2,1H3
InChIKeyUCBUINBCKUJEJQ-UHFFFAOYSA-N
XLogP2.94
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 ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-tert-butyl-1-(3,5-difluorophenyl)cyclohexan-1-amine
CID 63407310
1-(3-fluoro-5-methylphenyl)-3,5-dimethylcyclohexan-1-amine
CID 79704793
1-(2,5-difluorophenyl)-3-methylcyclopentan-1-amine
CID 64515768
3-tert-butyl-1-(3,5-difluorophenyl)cyclobutan-1-amine
CID 65014517
1-(5-fluoro-2-methylphenyl)-3-methylcyclopentan-1-amine
CID 64515524
1-(3,5-difluorophenyl)cyclopropan-1-amine;hydrochloride
CID 50944250
1-(3,5-difluorophenyl)-4-phenylcyclohexan-1-amine
CID 62788504
3-methyl-1-[4-(trifluoromethyl)phenyl]cyclopentan-1-amine
CID 64516236
1-(4-tert-butylphenyl)-3-methylcyclopentan-1-amine
CID 64513866
1-(3,5-difluorophenyl)-3-propan-2-ylcyclobutan-1-amine
CID 65017083
1-(3,5-difluorophenyl)-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 63407873
1-(2,3-difluoro-4-methylphenyl)-3-methylcyclopentan-1-amine
CID 107512496

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine?
The IUPAC name of 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine (CID 64516724) is 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine is CC1CCC(N)(c2cc(F)cc(F)c2)C1.
What is the InChIKey of 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine?
The InChIKey is UCBUINBCKUJEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2N/c1-8-2-3-12(15,7-8)9-4-10(13)6-11(14)5-9/h4-6,8H,2-3,7,15H2,1H3.
What are the key properties of 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine?
1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine has a molecular weight of 211.25 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 64516724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).