2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine

C14H14ClFN2 — CID 156896188

IUPAC2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine
SMILESCC(C)(N)c1ccnc(-c2ccc(F)cc2)c1Cl
InChIInChI=1S/C14H14ClFN2/c1-14(2,17)11-7-8-18-13(12(11)15)9-3-5-10(16)6-4-9/h3-8H,17H2,1-2H3
InChIKeyFWQADYSYGWWLHB-UHFFFAOYSA-N
MW264.73 g/mol
LogP3.73
Rot. Bonds2

About 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine

2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine (PubChem CID 156896188) has the molecular formula C14H14ClFN2 and a molecular weight of 264.73 g/mol. Its IUPAC name is 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine
PubChem CID156896188
Molecular FormulaC14H14ClFN2
Molecular Weight264.73 g/mol
Exact Mass264.08
IUPAC Name2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine
SMILESCC(C)(N)c1ccnc(-c2ccc(F)cc2)c1Cl
InChIInChI=1S/C14H14ClFN2/c1-14(2,17)11-7-8-18-13(12(11)15)9-3-5-10(16)6-4-9/h3-8H,17H2,1-2H3
InChIKeyFWQADYSYGWWLHB-UHFFFAOYSA-N
XLogP3.73
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.73
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-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 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine?
The IUPAC name of 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine (CID 156896188) is 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine.
What is the SMILES notation for 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine?
The canonical SMILES for 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine is CC(C)(N)c1ccnc(-c2ccc(F)cc2)c1Cl.
What is the InChIKey of 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine?
The InChIKey is FWQADYSYGWWLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2/c1-14(2,17)11-7-8-18-13(12(11)15)9-3-5-10(16)6-4-9/h3-8H,17H2,1-2H3.
What are the key properties of 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine?
2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine has a molecular weight of 264.73 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-amine is sourced from PubChem (CID 156896188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).