2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine

C20H24N4O — CID 25009298

IUPAC2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
SMILESCOc1ccc(C2CCN(Cc3nc4ncccc4n3C)CC2)cc1
InChIInChI=1S/C20H24N4O/c1-23-18-4-3-11-21-20(18)22-19(23)14-24-12-9-16(10-13-24)15-5-7-17(25-2)8-6-15/h3-8,11,16H,9-10,12-14H2,1-2H3
InChIKeyDXJMDNPTDBBNKE-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.36
Rot. Bonds4

About 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine

2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine (PubChem CID 25009298) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
PubChem CID25009298
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
SMILESCOc1ccc(C2CCN(Cc3nc4ncccc4n3C)CC2)cc1
InChIInChI=1S/C20H24N4O/c1-23-18-4-3-11-21-20(18)22-19(23)14-24-12-9-16(10-13-24)15-5-7-17(25-2)8-6-15/h3-8,11,16H,9-10,12-14H2,1-2H3
InChIKeyDXJMDNPTDBBNKE-UHFFFAOYSA-N
XLogP3.36
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[4-(2-methoxyphenyl)-3-methylpiperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
CID 25008792
2-[[4-[2-fluoro-5-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
CID 25008790
[2-[1-[(1-methylimidazo[4,5-b]pyridin-2-yl)methyl]piperidin-4-yl]-5-(trifluoromethyl)-3-pyridinyl] thiohypofluorite
CID 156817928
2-[[4-[3-ethenoxy-5-(trifluoromethyl)-2-pyridinyl]piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
CID 166706029
2-[[4-(2,5-dimethoxyphenyl)piperidin-1-yl]methyl]-3-methylimidazo[4,5-b]pyridine
CID 25010195
2-[[(3R,4R)-4-[2-methoxy-4-(trifluoromethyl)phenyl]-3-methylpiperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
CID 51357936
4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine
CID 50950194
2-[[4-[3-(111C)methoxy-5-(trifluoromethyl)-2-pyridinyl]-3-methylpiperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
CID 159345660
3-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1,2-oxazole
CID 71867470
1-[2-[2-[4-(4-methoxyphenyl)piperidin-1-yl]ethoxy]ethyl]benzimidazole
CID 139918390
3-[4-(4-methoxyphenyl)piperidin-1-yl]propan-1-amine
CID 94689546
2-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]-1-methylbenzimidazol-4-amine
CID 69163958

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine?
The IUPAC name of 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine (CID 25009298) is 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine is COc1ccc(C2CCN(Cc3nc4ncccc4n3C)CC2)cc1.
What is the InChIKey of 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine?
The InChIKey is DXJMDNPTDBBNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-23-18-4-3-11-21-20(18)22-19(23)14-24-12-9-16(10-13-24)15-5-7-17(25-2)8-6-15/h3-8,11,16H,9-10,12-14H2,1-2H3.
What are the key properties of 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine?
2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine has a molecular weight of 336.44 g/mol, XLogP of 3.36, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine is sourced from PubChem (CID 25009298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).