3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine

C12H11N3S — CID 117141839

IUPAC3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine
SMILESCc1ccc(-c2ncc3cccc(N)n23)s1
InChIInChI=1S/C12H11N3S/c1-8-5-6-10(16-8)12-14-7-9-3-2-4-11(13)15(9)12/h2-7H,13H2,1H3
InChIKeyRHXYGKKSLBMFHB-UHFFFAOYSA-N
MW229.31 g/mol
LogP2.95
Rot. Bonds1

About 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine

3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine (PubChem CID 117141839) has the molecular formula C12H11N3S and a molecular weight of 229.31 g/mol. Its IUPAC name is 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine
PubChem CID117141839
Molecular FormulaC12H11N3S
Molecular Weight229.31 g/mol
Exact Mass229.07
IUPAC Name3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine
SMILESCc1ccc(-c2ncc3cccc(N)n23)s1
InChIInChI=1S/C12H11N3S/c1-8-5-6-10(16-8)12-14-7-9-3-2-4-11(13)15(9)12/h2-7H,13H2,1H3
InChIKeyRHXYGKKSLBMFHB-UHFFFAOYSA-N
XLogP2.95
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine?
The IUPAC name of 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine (CID 117141839) is 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine?
The canonical SMILES for 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine is Cc1ccc(-c2ncc3cccc(N)n23)s1.
What is the InChIKey of 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine?
The InChIKey is RHXYGKKSLBMFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3S/c1-8-5-6-10(16-8)12-14-7-9-3-2-4-11(13)15(9)12/h2-7H,13H2,1H3.
What are the key properties of 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine?
3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine has a molecular weight of 229.31 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117141839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).