5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C23H26N4O — CID 77085545

IUPAC5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1cncc(-c2nc3c([nH]2)CN(Cc2ccccc2OC2CCCC2)CC3)c1
InChIInChI=1S/C23H26N4O/c1-4-10-22(28-19-8-2-3-9-19)18(6-1)15-27-13-11-20-21(16-27)26-23(25-20)17-7-5-12-24-14-17/h1,4-7,10,12,14,19H,2-3,8-9,11,13,15-16H2,(H,25,26)
InChIKeyNTZFIWGSFSFUMH-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.35
Rot. Bonds5

About 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 77085545) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID77085545
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1cncc(-c2nc3c([nH]2)CN(Cc2ccccc2OC2CCCC2)CC3)c1
InChIInChI=1S/C23H26N4O/c1-4-10-22(28-19-8-2-3-9-19)18(6-1)15-27-13-11-20-21(16-27)26-23(25-20)17-7-5-12-24-14-17/h1,4-7,10,12,14,19H,2-3,8-9,11,13,15-16H2,(H,25,26)
InChIKeyNTZFIWGSFSFUMH-UHFFFAOYSA-N
XLogP4.35
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

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Related Compounds

2-propan-2-yl-4-[(2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methyl]-1,3-oxazole
CID 77086270
6-(naphthalen-1-ylmethyl)-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135916495
6-[(2-bromophenyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135917395
7-[(2-ethylphenyl)methyl]-2-pyridin-3-yl-3,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 135864449
6-[(3-methoxy-2-nitrophenyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135919132
6-[(2-fluoro-3-pyridinyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135944567
5-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-fluorophenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 74244350
6-[(2,3-dimethylphenyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135916755
6-[(2,6-dimethoxyphenyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135917335
2-(4-aminophenyl)-6-[(2-cyclopentyloxy-3-pyridinyl)methyl]-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135947386
6-[(2-hydroxy-3-methylphenyl)methyl]-2-pyridin-3-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135917975
pyridin-4-yl-(2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 77085984

Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 77085545) is 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is c1cncc(-c2nc3c([nH]2)CN(Cc2ccccc2OC2CCCC2)CC3)c1.
What is the InChIKey of 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is NTZFIWGSFSFUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-4-10-22(28-19-8-2-3-9-19)18(6-1)15-27-13-11-20-21(16-27)26-23(25-20)17-7-5-12-24-14-17/h1,4-7,10,12,14,19H,2-3,8-9,11,13,15-16H2,(H,25,26).
What are the key properties of 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 374.49 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyclopentyloxyphenyl)methyl]-2-pyridin-3-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 77085545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).