3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine

C11H7ClF2N2 — CID 176730012

IUPAC3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine
SMILESNc1c(Cl)cncc1-c1ccc(F)cc1F
InChIInChI=1S/C11H7ClF2N2/c12-9-5-16-4-8(11(9)15)7-2-1-6(13)3-10(7)14/h1-5H,(H2,15,16)
InChIKeyFBJWKANVOZNNFP-UHFFFAOYSA-N
MW240.64 g/mol
LogP3.26
Rot. Bonds1

About 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine

3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine (PubChem CID 176730012) has the molecular formula C11H7ClF2N2 and a molecular weight of 240.64 g/mol. Its IUPAC name is 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine.

Molecular Properties

Compound Name3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine
PubChem CID176730012
Molecular FormulaC11H7ClF2N2
Molecular Weight240.64 g/mol
Exact Mass240.03
IUPAC Name3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine
SMILESNc1c(Cl)cncc1-c1ccc(F)cc1F
InChIInChI=1S/C11H7ClF2N2/c12-9-5-16-4-8(11(9)15)7-2-1-6(13)3-10(7)14/h1-5H,(H2,15,16)
InChIKeyFBJWKANVOZNNFP-UHFFFAOYSA-N
XLogP3.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.64
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine?
The IUPAC name of 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine (CID 176730012) is 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine.
What is the SMILES notation for 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine?
The canonical SMILES for 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine is Nc1c(Cl)cncc1-c1ccc(F)cc1F.
What is the InChIKey of 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine?
The InChIKey is FBJWKANVOZNNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF2N2/c12-9-5-16-4-8(11(9)15)7-2-1-6(13)3-10(7)14/h1-5H,(H2,15,16).
What are the key properties of 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine?
3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine has a molecular weight of 240.64 g/mol, XLogP of 3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(2,4-difluorophenyl)pyridin-4-amine is sourced from PubChem (CID 176730012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).