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

C15H17ClN2 — CID 117249313

IUPAC1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCc1cccc(-c2nc(Cl)c3n2CCC(C)C3)c1
InChIInChI=1S/C15H17ClN2/c1-10-4-3-5-12(8-10)15-17-14(16)13-9-11(2)6-7-18(13)15/h3-5,8,11H,6-7,9H2,1-2H3
InChIKeyUENKJCVAHNJGIH-UHFFFAOYSA-N
MW260.77 g/mol
LogP4.09
Rot. Bonds1

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

1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 117249313) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID117249313
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCc1cccc(-c2nc(Cl)c3n2CCC(C)C3)c1
InChIInChI=1S/C15H17ClN2/c1-10-4-3-5-12(8-10)15-17-14(16)13-9-11(2)6-7-18(13)15/h3-5,8,11H,6-7,9H2,1-2H3
InChIKeyUENKJCVAHNJGIH-UHFFFAOYSA-N
XLogP4.09
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-bromo-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249314
1-chloro-7-methyl-3-[4-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249432
3-(3-chlorophenyl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249323
1-chloro-3-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
CID 117249287
7-methyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 83218385
1-chloro-7-methyl-3-(oxan-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249038
1-chloro-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxylic acid
CID 117249395
1-bromo-3-(5-chlorofuran-2-yl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249120
7-methyl-3-[(3-methylphenyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 117151565
3-(3-methylphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 83965873
(7R)-2-(3-chlorophenyl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462565
1-bromo-3-(furan-2-yl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249116

Frequently Asked Questions

What is the IUPAC name of 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 117249313) is 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is Cc1cccc(-c2nc(Cl)c3n2CCC(C)C3)c1.
What is the InChIKey of 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is UENKJCVAHNJGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-10-4-3-5-12(8-10)15-17-14(16)13-9-11(2)6-7-18(13)15/h3-5,8,11H,6-7,9H2,1-2H3.
What are the key properties of 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 260.77 g/mol, XLogP of 4.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-7-methyl-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 117249313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).