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

C14H13N3S2 — CID 82106433

IUPAC[5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2ccsc2)c(Cc2ccccn2)s1
InChIInChI=1S/C14H13N3S2/c15-8-13-17-14(10-4-6-18-9-10)12(19-13)7-11-3-1-2-5-16-11/h1-6,9H,7-8,15H2
InChIKeyYNWNVYWYNGNPIO-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.32
Rot. Bonds4

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

[5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine (PubChem CID 82106433) has the molecular formula C14H13N3S2 and a molecular weight of 287.41 g/mol. Its IUPAC name is [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine
PubChem CID82106433
Molecular FormulaC14H13N3S2
Molecular Weight287.41 g/mol
Exact Mass287.06
IUPAC Name[5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2ccsc2)c(Cc2ccccn2)s1
InChIInChI=1S/C14H13N3S2/c15-8-13-17-14(10-4-6-18-9-10)12(19-13)7-11-3-1-2-5-16-11/h1-6,9H,7-8,15H2
InChIKeyYNWNVYWYNGNPIO-UHFFFAOYSA-N
XLogP3.32
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [5-(pyridin-2-ylmethyl)-4-thiophen-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-methyl-4-thiophen-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106270
(5-propan-2-yl-4-thiophen-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106559
(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
CID 68582558
[5-benzyl-4-(3-methylphenyl)-1,3-thiazol-2-yl]methanamine
CID 82106460
2-(4-phenyl-2-thiophen-3-yl-1,3-thiazol-5-yl)ethanamine
CID 79786144
[4-(4-fluorophenyl)-5-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]methanamine
CID 82106468
(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
CID 62403368
[4-(3-fluorophenyl)-5-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]methanamine
CID 82106482
(2-thiophen-3-ylpyrimidin-4-yl)methanamine
CID 62749673
4-phenyl-2-(pyridin-2-ylmethyl)-1,3-thiazole
CID 31263387
5-methyl-2-(pyridin-2-ylmethyl)-1,3-thiazol-4-amine
CID 83107325
[3-(pyridin-2-ylmethoxy)thiophen-2-yl]methanamine
CID 39202938

Frequently Asked Questions

What is the IUPAC name of [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine?
The IUPAC name of [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine (CID 82106433) is [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine.
What is the SMILES notation for [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine?
The canonical SMILES for [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine is NCc1nc(-c2ccsc2)c(Cc2ccccn2)s1.
What is the InChIKey of [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine?
The InChIKey is YNWNVYWYNGNPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S2/c15-8-13-17-14(10-4-6-18-9-10)12(19-13)7-11-3-1-2-5-16-11/h1-6,9H,7-8,15H2.
What are the key properties of [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine?
[5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine has a molecular weight of 287.41 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(pyridin-2-ylmethyl)-4-thiophen-3-yl-1,3-thiazol-2-yl]methanamine is sourced from PubChem (CID 82106433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).