3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C16H20N2 — CID 130429439

IUPAC3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)c1ccc(-c2ncc3n2CCCC3)cc1
InChIInChI=1S/C16H20N2/c1-12(2)13-6-8-14(9-7-13)16-17-11-15-5-3-4-10-18(15)16/h6-9,11-12H,3-5,10H2,1-2H3
InChIKeyJXKMLZNYXFOGCV-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.01
Rot. Bonds2

About 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 130429439) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID130429439
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)c1ccc(-c2ncc3n2CCCC3)cc1
InChIInChI=1S/C16H20N2/c1-12(2)13-6-8-14(9-7-13)16-17-11-15-5-3-4-10-18(15)16/h6-9,11-12H,3-5,10H2,1-2H3
InChIKeyJXKMLZNYXFOGCV-UHFFFAOYSA-N
XLogP4.01
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 146634254
lithium 4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)benzoate
CID 130405932
2-methyl-3-(methylamino)-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]propanamide
CID 119858470
3-amino-2-methyl-3-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]propanamide;dihydrochloride
CID 119858447
3-(4-bromo-3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 146644321
2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide
CID 112833184
2-benzylsulfanyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]propanamide
CID 112833356
6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
CID 112833096
3-amino-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]cyclopentane-1-carboxamide
CID 119858442
2-(4-propoxyphenoxy)-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]acetamide
CID 112832914
2-(2-ethoxyphenoxy)-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]acetamide
CID 166190257
3-bromo-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]benzamide
CID 112833016

Frequently Asked Questions

What is the IUPAC name of 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 130429439) is 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC(C)c1ccc(-c2ncc3n2CCCC3)cc1.
What is the InChIKey of 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is JXKMLZNYXFOGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-12(2)13-6-8-14(9-7-13)16-17-11-15-5-3-4-10-18(15)16/h6-9,11-12H,3-5,10H2,1-2H3.
What are the key properties of 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 240.35 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 130429439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).