1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C13H15ClN2S — CID 117248844

IUPAC1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCc2c(Cl)nc(Cc3cccs3)n2C1
InChIInChI=1S/C13H15ClN2S/c1-9-4-5-11-13(14)15-12(16(11)8-9)7-10-3-2-6-17-10/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyTVGXOLXBWINVHZ-UHFFFAOYSA-N
MW266.80 g/mol
LogP3.77
Rot. Bonds2

About 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 117248844) has the molecular formula C13H15ClN2S and a molecular weight of 266.80 g/mol. Its IUPAC name is 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID117248844
Molecular FormulaC13H15ClN2S
Molecular Weight266.80 g/mol
Exact Mass266.06
IUPAC Name1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCc2c(Cl)nc(Cc3cccs3)n2C1
InChIInChI=1S/C13H15ClN2S/c1-9-4-5-11-13(14)15-12(16(11)8-9)7-10-3-2-6-17-10/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyTVGXOLXBWINVHZ-UHFFFAOYSA-N
XLogP3.77
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.80
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine with MolForge

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Related Compounds

1-chloro-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117248156
6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117149200
2-(1-chloro-6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol
CID 117248205
1-chloro-6-methyl-3-(2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117248700
3-benzyl-1-chloro-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
CID 117248484
5-bromo-2-methyl-1-(2-thiophen-2-ylethyl)piperidine
CID 130825934
5-chloro-1-methyl-2-(thiophen-2-ylmethyl)imidazole
CID 117259295
4-chloro-2-cyclopropyl-6-(thiophen-2-ylmethyl)pyrimidine
CID 121205893
4-(1-chloro-6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)thiane 1,1-dioxide
CID 117248358
[2-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol
CID 117153713
5-chloro-3-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117142407
1-chloro-3-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117252076

Frequently Asked Questions

What is the IUPAC name of 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 117248844) is 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC1CCc2c(Cl)nc(Cc3cccs3)n2C1.
What is the InChIKey of 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is TVGXOLXBWINVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2S/c1-9-4-5-11-13(14)15-12(16(11)8-9)7-10-3-2-6-17-10/h2-3,6,9H,4-5,7-8H2,1H3.
What are the key properties of 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 266.80 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-6-methyl-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 117248844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).