6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine

C15H16FN3 — CID 22624304

IUPAC6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine
SMILESNc1cccc(-c2ccc(C3CCNC3)cc2F)n1
InChIInChI=1S/C15H16FN3/c16-13-8-10(11-6-7-18-9-11)4-5-12(13)14-2-1-3-15(17)19-14/h1-5,8,11,18H,6-7,9H2,(H2,17,19)
InChIKeyYVTQRJWTWBGGRV-UHFFFAOYSA-N
MW257.31 g/mol
LogP2.55
Rot. Bonds2

About 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine

6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine (PubChem CID 22624304) has the molecular formula C15H16FN3 and a molecular weight of 257.31 g/mol. Its IUPAC name is 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine
PubChem CID22624304
Molecular FormulaC15H16FN3
Molecular Weight257.31 g/mol
Exact Mass257.13
IUPAC Name6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine
SMILESNc1cccc(-c2ccc(C3CCNC3)cc2F)n1
InChIInChI=1S/C15H16FN3/c16-13-8-10(11-6-7-18-9-11)4-5-12(13)14-2-1-3-15(17)19-14/h1-5,8,11,18H,6-7,9H2,(H2,17,19)
InChIKeyYVTQRJWTWBGGRV-UHFFFAOYSA-N
XLogP2.55
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine?
The IUPAC name of 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine (CID 22624304) is 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine?
The canonical SMILES for 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine is Nc1cccc(-c2ccc(C3CCNC3)cc2F)n1.
What is the InChIKey of 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine?
The InChIKey is YVTQRJWTWBGGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3/c16-13-8-10(11-6-7-18-9-11)4-5-12(13)14-2-1-3-15(17)19-14/h1-5,8,11,18H,6-7,9H2,(H2,17,19).
What are the key properties of 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine?
6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine has a molecular weight of 257.31 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-pyrrolidin-3-ylphenyl)pyridin-2-amine is sourced from PubChem (CID 22624304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).