2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine

C27H38N2 — CID 153324472

IUPAC2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine
SMILESCC(C)c1cc(C(C)C)c(C2=CC=CC3=CN(C4CCCC4)CN32)c(C(C)C)c1
InChIInChI=1S/C27H38N2/c1-18(2)21-14-24(19(3)4)27(25(15-21)20(5)6)26-13-9-12-23-16-28(17-29(23)26)22-10-7-8-11-22/h9,12-16,18-20,22H,7-8,10-11,17H2,1-6H3
InChIKeyZIQJLSVEDQFMKT-UHFFFAOYSA-N
MW390.62 g/mol
LogP7.33
Rot. Bonds5

About 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine

2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine (PubChem CID 153324472) has the molecular formula C27H38N2 and a molecular weight of 390.62 g/mol. Its IUPAC name is 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine
PubChem CID153324472
Molecular FormulaC27H38N2
Molecular Weight390.62 g/mol
Exact Mass390.30
IUPAC Name2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine
SMILESCC(C)c1cc(C(C)C)c(C2=CC=CC3=CN(C4CCCC4)CN32)c(C(C)C)c1
InChIInChI=1S/C27H38N2/c1-18(2)21-14-24(19(3)4)27(25(15-21)20(5)6)26-13-9-12-23-16-28(17-29(23)26)22-10-7-8-11-22/h9,12-16,18-20,22H,7-8,10-11,17H2,1-6H3
InChIKeyZIQJLSVEDQFMKT-UHFFFAOYSA-N
XLogP7.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.62
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine?
The IUPAC name of 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine (CID 153324472) is 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine.
What is the SMILES notation for 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine?
The canonical SMILES for 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine is CC(C)c1cc(C(C)C)c(C2=CC=CC3=CN(C4CCCC4)CN32)c(C(C)C)c1.
What is the InChIKey of 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine?
The InChIKey is ZIQJLSVEDQFMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H38N2/c1-18(2)21-14-24(19(3)4)27(25(15-21)20(5)6)26-13-9-12-23-16-28(17-29(23)26)22-10-7-8-11-22/h9,12-16,18-20,22H,7-8,10-11,17H2,1-6H3.
What are the key properties of 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine?
2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine has a molecular weight of 390.62 g/mol, XLogP of 7.33, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-[2,4,6-tri(propan-2-yl)phenyl]-3H-imidazo[1,5-a]pyridine is sourced from PubChem (CID 153324472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).