6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine

C15H22FN3 — CID 116812917

IUPAC6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine
SMILESFc1cccc(NC2CCCCC2C2CCCN2)n1
InChIInChI=1S/C15H22FN3/c16-14-8-3-9-15(19-14)18-13-6-2-1-5-11(13)12-7-4-10-17-12/h3,8-9,11-13,17H,1-2,4-7,10H2,(H,18,19)
InChIKeyTVUJMJVVWSUCBD-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.94
Rot. Bonds3

About 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine

6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine (PubChem CID 116812917) has the molecular formula C15H22FN3 and a molecular weight of 263.36 g/mol. Its IUPAC name is 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine
PubChem CID116812917
Molecular FormulaC15H22FN3
Molecular Weight263.36 g/mol
Exact Mass263.18
IUPAC Name6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine
SMILESFc1cccc(NC2CCCCC2C2CCCN2)n1
InChIInChI=1S/C15H22FN3/c16-14-8-3-9-15(19-14)18-13-6-2-1-5-11(13)12-7-4-10-17-12/h3,8-9,11-13,17H,1-2,4-7,10H2,(H,18,19)
InChIKeyTVUJMJVVWSUCBD-UHFFFAOYSA-N
XLogP2.94
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)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 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine?
The IUPAC name of 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine (CID 116812917) is 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine?
The canonical SMILES for 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine is Fc1cccc(NC2CCCCC2C2CCCN2)n1.
What is the InChIKey of 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine?
The InChIKey is TVUJMJVVWSUCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3/c16-14-8-3-9-15(19-14)18-13-6-2-1-5-11(13)12-7-4-10-17-12/h3,8-9,11-13,17H,1-2,4-7,10H2,(H,18,19).
What are the key properties of 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine?
6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine has a molecular weight of 263.36 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(2-pyrrolidin-2-ylcyclohexyl)pyridin-2-amine is sourced from PubChem (CID 116812917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).