3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C24H27N3O2 — CID 143944102

IUPAC3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCOc1ccc(OC)c(CN2CCc3nc(-c4ccccc4)n(C4CC4)c3C2)c1
InChIInChI=1S/C24H27N3O2/c1-28-20-10-11-23(29-2)18(14-20)15-26-13-12-21-22(16-26)27(19-8-9-19)24(25-21)17-6-4-3-5-7-17/h3-7,10-11,14,19H,8-9,12-13,15-16H2,1-2H3
InChIKeyZGJPUDCPNVHLKO-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.46
Rot. Bonds6

About 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 143944102) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
PubChem CID143944102
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC Name3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCOc1ccc(OC)c(CN2CCc3nc(-c4ccccc4)n(C4CC4)c3C2)c1
InChIInChI=1S/C24H27N3O2/c1-28-20-10-11-23(29-2)18(14-20)15-26-13-12-21-22(16-26)27(19-8-9-19)24(25-21)17-6-4-3-5-7-17/h3-7,10-11,14,19H,8-9,12-13,15-16H2,1-2H3
InChIKeyZGJPUDCPNVHLKO-UHFFFAOYSA-N
XLogP4.46
TPSA39.52 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The IUPAC name of 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 143944102) is 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The canonical SMILES for 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is COc1ccc(OC)c(CN2CCc3nc(-c4ccccc4)n(C4CC4)c3C2)c1.
What is the InChIKey of 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The InChIKey is ZGJPUDCPNVHLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-28-20-10-11-23(29-2)18(14-20)15-26-13-12-21-22(16-26)27(19-8-9-19)24(25-21)17-6-4-3-5-7-17/h3-7,10-11,14,19H,8-9,12-13,15-16H2,1-2H3.
What are the key properties of 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 389.50 g/mol, XLogP of 4.46, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-[(2,5-dimethoxyphenyl)methyl]-2-phenyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 143944102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).