5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine

C14H12N2S — CID 115113658

IUPAC5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine
SMILESCc1ccc2cc(-c3ccc(N)nc3)sc2c1
InChIInChI=1S/C14H12N2S/c1-9-2-3-10-7-13(17-12(10)6-9)11-4-5-14(15)16-8-11/h2-8H,1H3,(H2,15,16)
InChIKeyMQMOUJLNSVBFJT-UHFFFAOYSA-N
MW240.33 g/mol
LogP3.85
Rot. Bonds1

About 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine

5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine (PubChem CID 115113658) has the molecular formula C14H12N2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine
PubChem CID115113658
Molecular FormulaC14H12N2S
Molecular Weight240.33 g/mol
Exact Mass240.07
IUPAC Name5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine
SMILESCc1ccc2cc(-c3ccc(N)nc3)sc2c1
InChIInChI=1S/C14H12N2S/c1-9-2-3-10-7-13(17-12(10)6-9)11-4-5-14(15)16-8-11/h2-8H,1H3,(H2,15,16)
InChIKeyMQMOUJLNSVBFJT-UHFFFAOYSA-N
XLogP3.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine?
The IUPAC name of 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine (CID 115113658) is 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine is Cc1ccc2cc(-c3ccc(N)nc3)sc2c1.
What is the InChIKey of 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine?
The InChIKey is MQMOUJLNSVBFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2S/c1-9-2-3-10-7-13(17-12(10)6-9)11-4-5-14(15)16-8-11/h2-8H,1H3,(H2,15,16).
What are the key properties of 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine?
5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine has a molecular weight of 240.33 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methyl-1-benzothiophen-2-yl)pyridin-2-amine is sourced from PubChem (CID 115113658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).