[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine

C15H12FN3S — CID 82106836

IUPAC[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2cccnc2)c(-c2cccc(F)c2)s1
InChIInChI=1S/C15H12FN3S/c16-12-5-1-3-10(7-12)15-14(19-13(8-17)20-15)11-4-2-6-18-9-11/h1-7,9H,8,17H2
InChIKeyKZNFJLPUTRGZHY-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.47
Rot. Bonds3

About [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine

[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine (PubChem CID 82106836) has the molecular formula C15H12FN3S and a molecular weight of 285.35 g/mol. Its IUPAC name is [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine
PubChem CID82106836
Molecular FormulaC15H12FN3S
Molecular Weight285.35 g/mol
Exact Mass285.07
IUPAC Name[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2cccnc2)c(-c2cccc(F)c2)s1
InChIInChI=1S/C15H12FN3S/c16-12-5-1-3-10(7-12)15-14(19-13(8-17)20-15)11-4-2-6-18-9-11/h1-7,9H,8,17H2
InChIKeyKZNFJLPUTRGZHY-UHFFFAOYSA-N
XLogP3.47
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine 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

[5-(3-fluorophenyl)-4-(2-methylphenyl)-1,3-thiazol-2-yl]methanamine
CID 82106600
(5-methyl-4-pyridin-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106363
[4-(3-fluorophenyl)-5-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]methanamine
CID 82106482
2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole
CID 22993797
[4-(3-fluorophenyl)-5-propan-2-yl-1,3-thiazol-2-yl]methanamine
CID 82106665
2-(aminomethyl)-5-pyridin-3-yl-1,3-thiazole-4-carbonitrile
CID 82471501
(5-cyclopentyl-4-pyridin-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106833
2-chloro-4,5-bis(3-fluorophenyl)-1,3-thiazole
CID 21409148
3-[5-(chloromethyl)-2-(3-fluorophenyl)-1H-imidazol-4-yl]pyridine;dihydrochloride
CID 67546965
[1-[(3-fluorophenyl)methyl]-5-pyridin-3-yltriazol-4-yl]methanamine
CID 82211840
[2-(3-fluorophenyl)-1,3-thiazol-5-yl]methanamine
CID 61280947
5-(3-fluorophenyl)-2-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide
CID 71709188

Frequently Asked Questions

What is the IUPAC name of [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine?
The IUPAC name of [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine (CID 82106836) is [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine.
What is the SMILES notation for [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine?
The canonical SMILES for [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine is NCc1nc(-c2cccnc2)c(-c2cccc(F)c2)s1.
What is the InChIKey of [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine?
The InChIKey is KZNFJLPUTRGZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3S/c16-12-5-1-3-10(7-12)15-14(19-13(8-17)20-15)11-4-2-6-18-9-11/h1-7,9H,8,17H2.
What are the key properties of [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine?
[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine has a molecular weight of 285.35 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine is sourced from PubChem (CID 82106836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).