N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine

C14H9ClFN3S — CID 165413147

IUPACN-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine
SMILESFc1ccc(Nc2csc(-c3ccccn3)n2)cc1Cl
InChIInChI=1S/C14H9ClFN3S/c15-10-7-9(4-5-11(10)16)18-13-8-20-14(19-13)12-3-1-2-6-17-12/h1-8,18H
InChIKeyXCFBFXSJAVYPKP-UHFFFAOYSA-N
MW305.77 g/mol
LogP4.74
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine

N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine (PubChem CID 165413147) has the molecular formula C14H9ClFN3S and a molecular weight of 305.77 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine
PubChem CID165413147
Molecular FormulaC14H9ClFN3S
Molecular Weight305.77 g/mol
Exact Mass305.02
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine
SMILESFc1ccc(Nc2csc(-c3ccccn3)n2)cc1Cl
InChIInChI=1S/C14H9ClFN3S/c15-10-7-9(4-5-11(10)16)18-13-8-20-14(19-13)12-3-1-2-6-17-12/h1-8,18H
InChIKeyXCFBFXSJAVYPKP-UHFFFAOYSA-N
XLogP4.74
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.77
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(3-chloro-4-fluorophenyl)pyridin-2-amine
CID 28829534
3,4-dichloro-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]aniline
CID 43234391
N-(3-chloro-4-fluorophenyl)-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9255638
2-pyridin-2-yl-4-(2-pyridin-2-yl-1,3-thiazol-4-yl)-1,3-thiazole
CID 15542721
2-(3-chloro-4-fluorophenyl)pyridine
CID 11644141
2-fluoro-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)aniline
CID 39164031
4-(2-chlorophenyl)-2-pyridin-2-yl-1,3-thiazole
CID 17475261
4-N-(3-chloro-4-fluorophenyl)pyrimidine-2,4-diamine
CID 80755292
2-N-(2-bromophenyl)-4-N-(3-chloro-4-fluorophenyl)pyrimidine-2,4-diamine
CID 112904141
6-phenyl-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]pyrimidin-4-amine
CID 108779744
6-phenyl-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]pyridazin-3-amine
CID 108779736
4-N-(3-chloro-4-fluorophenyl)-2-N-[2-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 112904127

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine (CID 165413147) is N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine is Fc1ccc(Nc2csc(-c3ccccn3)n2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine?
The InChIKey is XCFBFXSJAVYPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFN3S/c15-10-7-9(4-5-11(10)16)18-13-8-20-14(19-13)12-3-1-2-6-17-12/h1-8,18H.
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine?
N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine has a molecular weight of 305.77 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-pyridin-2-yl-1,3-thiazol-4-amine is sourced from PubChem (CID 165413147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).