N-[(2-fluorophenyl)methyl]cyclopentanamine

C12H16FN — CID 1080487

IUPACN-[(2-fluorophenyl)methyl]cyclopentanamine
SMILESFc1ccccc1CNC1CCCC1
InChIInChI=1S/C12H16FN/c13-12-8-4-1-5-10(12)9-14-11-6-2-3-7-11/h1,4-5,8,11,14H,2-3,6-7,9H2
InChIKeyRABPPLBEHXEIKW-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.86
Rot. Bonds3

About N-[(2-fluorophenyl)methyl]cyclopentanamine

N-[(2-fluorophenyl)methyl]cyclopentanamine (PubChem CID 1080487) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]cyclopentanamine
PubChem CID1080487
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC NameN-[(2-fluorophenyl)methyl]cyclopentanamine
SMILESFc1ccccc1CNC1CCCC1
InChIInChI=1S/C12H16FN/c13-12-8-4-1-5-10(12)9-14-11-6-2-3-7-11/h1,4-5,8,11,14H,2-3,6-7,9H2
InChIKeyRABPPLBEHXEIKW-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]cyclopentanamine?
The IUPAC name of N-[(2-fluorophenyl)methyl]cyclopentanamine (CID 1080487) is N-[(2-fluorophenyl)methyl]cyclopentanamine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]cyclopentanamine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]cyclopentanamine is Fc1ccccc1CNC1CCCC1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]cyclopentanamine?
The InChIKey is RABPPLBEHXEIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c13-12-8-4-1-5-10(12)9-14-11-6-2-3-7-11/h1,4-5,8,11,14H,2-3,6-7,9H2.
What are the key properties of N-[(2-fluorophenyl)methyl]cyclopentanamine?
N-[(2-fluorophenyl)methyl]cyclopentanamine has a molecular weight of 193.27 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]cyclopentanamine is sourced from PubChem (CID 1080487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).