3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine

C16H18N4S — CID 117236195

IUPAC3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine
SMILESCc1ccc(-c2ncc3cc(N4CCNCC4)ccn23)s1
InChIInChI=1S/C16H18N4S/c1-12-2-3-15(21-12)16-18-11-14-10-13(4-7-20(14)16)19-8-5-17-6-9-19/h2-4,7,10-11,17H,5-6,8-9H2,1H3
InChIKeyKSZGOPNQLNGYRK-UHFFFAOYSA-N
MW298.42 g/mol
LogP2.78
Rot. Bonds2

About 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine

3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine (PubChem CID 117236195) has the molecular formula C16H18N4S and a molecular weight of 298.42 g/mol. Its IUPAC name is 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine
PubChem CID117236195
Molecular FormulaC16H18N4S
Molecular Weight298.42 g/mol
Exact Mass298.13
IUPAC Name3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine
SMILESCc1ccc(-c2ncc3cc(N4CCNCC4)ccn23)s1
InChIInChI=1S/C16H18N4S/c1-12-2-3-15(21-12)16-18-11-14-10-13(4-7-20(14)16)19-8-5-17-6-9-19/h2-4,7,10-11,17H,5-6,8-9H2,1H3
InChIKeyKSZGOPNQLNGYRK-UHFFFAOYSA-N
XLogP2.78
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 117236205
3-ethyl-7-piperazin-1-ylimidazo[1,5-a]pyridine
CID 83894528
2-(7-piperazin-1-ylimidazo[1,5-a]pyridin-3-yl)ethanol
CID 117236108
3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine
CID 117236217
3-(5-methylthiophen-2-yl)-8-piperazin-1-ylimidazo[1,2-a]pyridine-6-carboxylic acid
CID 118168185
1-bromo-3-cyclopropyl-7-piperazin-1-ylimidazo[1,5-a]pyridine
CID 84604563
2-methyl-6-piperazin-1-ylquinoxaline
CID 117275288
1-(3,4-dimethylphenyl)piperazine;hydrochloride
CID 56766536
2-methyl-6-piperazin-1-yl-1H-benzimidazole
CID 20580687
5-(2-methylpyrimidin-5-yl)-N-(4-piperazin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 15979137
4-(5-bromothiophen-2-yl)-6-methyl-2-piperazin-1-ylpyrimidine
CID 116894826
1-[4-(5-methyl-1H-imidazol-2-yl)phenyl]-1,4-diazepane
CID 82482734

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The IUPAC name of 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine (CID 117236195) is 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine is Cc1ccc(-c2ncc3cc(N4CCNCC4)ccn23)s1.
What is the InChIKey of 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The InChIKey is KSZGOPNQLNGYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4S/c1-12-2-3-15(21-12)16-18-11-14-10-13(4-7-20(14)16)19-8-5-17-6-9-19/h2-4,7,10-11,17H,5-6,8-9H2,1H3.
What are the key properties of 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine?
3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine has a molecular weight of 298.42 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 117236195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).