1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine

C13H18FN — CID 64513406

IUPAC1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(N)(Cc2ccccc2F)C1
InChIInChI=1S/C13H18FN/c1-10-6-7-13(15,8-10)9-11-4-2-3-5-12(11)14/h2-5,10H,6-9,15H2,1H3
InChIKeyWFCLGRWUSZPGAN-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.89
Rot. Bonds2

About 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine

1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine (PubChem CID 64513406) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine
PubChem CID64513406
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(N)(Cc2ccccc2F)C1
InChIInChI=1S/C13H18FN/c1-10-6-7-13(15,8-10)9-11-4-2-3-5-12(11)14/h2-5,10H,6-9,15H2,1H3
InChIKeyWFCLGRWUSZPGAN-UHFFFAOYSA-N
XLogP2.89
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 ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2,5-difluorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 64513632
1-[(2-fluorophenyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63411451
1-[(2-fluorophenyl)methyl]cyclooctan-1-amine
CID 80603906
1-[(5-bromo-2-fluorophenyl)methyl]-4-methylcyclohexan-1-amine
CID 62595059
1-[(2-bromo-4-fluorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 64514094
1-[(2,6-difluorophenyl)methyl]-4-methylcyclohexan-1-amine
CID 114931200
1-[(4-chloro-2-fluorophenyl)methyl]-4-methylcyclohexan-1-amine
CID 114853407
1-[(4-chlorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 64516003
4-methyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-amine
CID 63407888
1-[(2-fluorophenyl)methyl]-2,3-dimethylcyclohexan-1-amine
CID 64774562
4-tert-butyl-1-[(2,3-difluorophenyl)methyl]cyclohexan-1-amine
CID 63408034
3,4-dimethyl-1-[(2-methylphenyl)methyl]cyclohexan-1-amine
CID 64733363

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine (CID 64513406) is 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine is CC1CCC(N)(Cc2ccccc2F)C1.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine?
The InChIKey is WFCLGRWUSZPGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-10-6-7-13(15,8-10)9-11-4-2-3-5-12(11)14/h2-5,10H,6-9,15H2,1H3.
What are the key properties of 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine?
1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine has a molecular weight of 207.29 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 64513406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).