N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine

C14H9ClN6S — CID 53325884

IUPACN-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine
SMILESClc1cccc(Nc2nc(-c3nn[nH]n3)cc3sccc23)c1
InChIInChI=1S/C14H9ClN6S/c15-8-2-1-3-9(6-8)16-13-10-4-5-22-12(10)7-11(17-13)14-18-20-21-19-14/h1-7H,(H,16,17)(H,18,19,20,21)
InChIKeyNWIMKTFZXUQFDX-UHFFFAOYSA-N
MW328.79 g/mol
LogP3.87
Rot. Bonds3

About N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine

N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine (PubChem CID 53325884) has the molecular formula C14H9ClN6S and a molecular weight of 328.79 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine
PubChem CID53325884
Molecular FormulaC14H9ClN6S
Molecular Weight328.79 g/mol
Exact Mass328.03
IUPAC NameN-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine
SMILESClc1cccc(Nc2nc(-c3nn[nH]n3)cc3sccc23)c1
InChIInChI=1S/C14H9ClN6S/c15-8-2-1-3-9(6-8)16-13-10-4-5-22-12(10)7-11(17-13)14-18-20-21-19-14/h1-7H,(H,16,17)(H,18,19,20,21)
InChIKeyNWIMKTFZXUQFDX-UHFFFAOYSA-N
XLogP3.87
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.79
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-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

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine (CID 53325884) is N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine is Clc1cccc(Nc2nc(-c3nn[nH]n3)cc3sccc23)c1.
What is the InChIKey of N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is NWIMKTFZXUQFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN6S/c15-8-2-1-3-9(6-8)16-13-10-4-5-22-12(10)7-11(17-13)14-18-20-21-19-14/h1-7H,(H,16,17)(H,18,19,20,21).
What are the key properties of N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine?
N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 328.79 g/mol, XLogP of 3.87, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-(2H-tetrazol-5-yl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 53325884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).