N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine

C14H11FN4S — CID 166341288

IUPACN-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESFc1cncc(CNc2nc(-c3cccnc3)cs2)c1
InChIInChI=1S/C14H11FN4S/c15-12-4-10(5-17-8-12)6-18-14-19-13(9-20-14)11-2-1-3-16-7-11/h1-5,7-9H,6H2,(H,18,19)
InChIKeyAAJJFDCGNNUOIE-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.35
Rot. Bonds4

About N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine

N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 166341288) has the molecular formula C14H11FN4S and a molecular weight of 286.34 g/mol. Its IUPAC name is N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID166341288
Molecular FormulaC14H11FN4S
Molecular Weight286.34 g/mol
Exact Mass286.07
IUPAC NameN-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESFc1cncc(CNc2nc(-c3cccnc3)cs2)c1
InChIInChI=1S/C14H11FN4S/c15-12-4-10(5-17-8-12)6-18-14-19-13(9-20-14)11-2-1-3-16-7-11/h1-5,7-9H,6H2,(H,18,19)
InChIKeyAAJJFDCGNNUOIE-UHFFFAOYSA-N
XLogP3.35
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-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

Related Compounds

N-benzyl-4-(5-fluoro-3-pyridinyl)-1,3-thiazol-2-amine
CID 130556959
N-(naphthalen-1-ylmethyl)-4-pyridin-3-yl-1,3-thiazol-2-amine;hydrobromide
CID 87929254
N-tert-butyl-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 62942552
N,4-dipyridin-3-yl-1,3-thiazol-2-amine
CID 2215784
N-(2-phenylethyl)-4-[4-[3-[2-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]ethyl]phenyl]phenyl]-1,3-thiazol-2-amine
CID 134241887
N-[2-(3-phenoxyphenyl)ethyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791260
N-[2-[3-[4-[2-(2,4-difluoroanilino)-1,3-thiazol-4-yl]phenyl]phenyl]ethyl]-4-[4-[3-[2-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]ethyl]phenyl]phenyl]-1,3-thiazol-2-amine
CID 134241813
N-[4-(3-fluorophenoxy)phenyl]-2-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]acetamide
CID 66562471
N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58910456
N-[3-(difluoromethyl)-4-fluorophenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 143328866
2-[(4-fluorophenyl)methyl]-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 75466812
N-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]ethanamine
CID 62544977

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine (CID 166341288) is N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine is Fc1cncc(CNc2nc(-c3cccnc3)cs2)c1.
What is the InChIKey of N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is AAJJFDCGNNUOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN4S/c15-12-4-10(5-17-8-12)6-18-14-19-13(9-20-14)11-2-1-3-16-7-11/h1-5,7-9H,6H2,(H,18,19).
What are the key properties of N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 286.34 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-3-pyridinyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 166341288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).