6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine

C23H28N4O — CID 97447615

IUPAC6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc(C3CCN(CC4CC4)CC3)cc3c2ncn3C)cc1
InChIInChI=1S/C23H28N4O/c1-26-15-24-23-21(26)13-20(17-9-11-27(12-10-17)14-16-3-4-16)25-22(23)18-5-7-19(28-2)8-6-18/h5-8,13,15-17H,3-4,9-12,14H2,1-2H3
InChIKeyWEAOCKGWZYZUBJ-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.23
Rot. Bonds5

About 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine

6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine (PubChem CID 97447615) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine
PubChem CID97447615
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc(C3CCN(CC4CC4)CC3)cc3c2ncn3C)cc1
InChIInChI=1S/C23H28N4O/c1-26-15-24-23-21(26)13-20(17-9-11-27(12-10-17)14-16-3-4-16)25-22(23)18-5-7-19(28-2)8-6-18/h5-8,13,15-17H,3-4,9-12,14H2,1-2H3
InChIKeyWEAOCKGWZYZUBJ-UHFFFAOYSA-N
XLogP4.23
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine?
The IUPAC name of 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine (CID 97447615) is 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine.
What is the SMILES notation for 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine?
The canonical SMILES for 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine is COc1ccc(-c2nc(C3CCN(CC4CC4)CC3)cc3c2ncn3C)cc1.
What is the InChIKey of 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine?
The InChIKey is WEAOCKGWZYZUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c1-26-15-24-23-21(26)13-20(17-9-11-27(12-10-17)14-16-3-4-16)25-22(23)18-5-7-19(28-2)8-6-18/h5-8,13,15-17H,3-4,9-12,14H2,1-2H3.
What are the key properties of 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine?
6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine has a molecular weight of 376.50 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(cyclopropylmethyl)piperidin-4-yl]-4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridine is sourced from PubChem (CID 97447615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).