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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Related Compounds

6-(thiophen-3-yl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538803
Agl 2043
CID 9817165
Ikk-IN-3
CID 10215156
N,4,12-trimethyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823920
12-Methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823959
N,12-dimethyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823960
12-methyl-4-phenyl-N-[2-(piperidin-1-yl)ethyl]-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823975
Dimethyl[2-({12-methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-yl}amino)ethyl]amine
CID 20823982
N-ethyl-12-methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20824060
8-(4-Prop-2-enylpiperazin-1-yl)-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 10756517
Thiazolo(5,4-b)pyridin-2-amine, N-ethyl-
CID 2747540
1-Methyl-2-thiophen-2-ylbenzimidazole
CID 931177

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).