5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine

C12H17FN2 — CID 63830121

IUPAC5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1(CNc2ccc(F)cn2)CCCC1
InChIInChI=1S/C12H17FN2/c1-12(6-2-3-7-12)9-15-11-5-4-10(13)8-14-11/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,15)
InChIKeyHOEPAWBFQLLNJB-UHFFFAOYSA-N
MW208.28 g/mol
LogP3.21
Rot. Bonds3

About 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine

5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine (PubChem CID 63830121) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine
PubChem CID63830121
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1(CNc2ccc(F)cn2)CCCC1
InChIInChI=1S/C12H17FN2/c1-12(6-2-3-7-12)9-15-11-5-4-10(13)8-14-11/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,15)
InChIKeyHOEPAWBFQLLNJB-UHFFFAOYSA-N
XLogP3.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine?
The IUPAC name of 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine (CID 63830121) is 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine is CC1(CNc2ccc(F)cn2)CCCC1.
What is the InChIKey of 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine?
The InChIKey is HOEPAWBFQLLNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-12(6-2-3-7-12)9-15-11-5-4-10(13)8-14-11/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,15).
What are the key properties of 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine?
5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine has a molecular weight of 208.28 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine is sourced from PubChem (CID 63830121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).