4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one

C21H24N6O — CID 155272770

IUPAC4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one
SMILESCc1cc(-c2cc(C)c3ncnn3c2)cc2[nH]c(=O)n(C3CCN(C)CC3)c12
InChIInChI=1S/C21H24N6O/c1-13-8-15(16-9-14(2)20-22-12-23-26(20)11-16)10-18-19(13)27(21(28)24-18)17-4-6-25(3)7-5-17/h8-12,17H,4-7H2,1-3H3,(H,24,28)
InChIKeyQQUBZTAWGKSVJZ-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.92
Rot. Bonds2

About 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one

4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one (PubChem CID 155272770) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one.

Molecular Properties

Compound Name4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one
PubChem CID155272770
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one
SMILESCc1cc(-c2cc(C)c3ncnn3c2)cc2[nH]c(=O)n(C3CCN(C)CC3)c12
InChIInChI=1S/C21H24N6O/c1-13-8-15(16-9-14(2)20-22-12-23-26(20)11-16)10-18-19(13)27(21(28)24-18)17-4-6-25(3)7-5-17/h8-12,17H,4-7H2,1-3H3,(H,24,28)
InChIKeyQQUBZTAWGKSVJZ-UHFFFAOYSA-N
XLogP2.92
TPSA71.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[4-(dimethylamino)cyclohexyl]-5-methyl-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one
CID 155272641
5-methyl-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-[4-[(1-methyl-1,2,4-triazol-3-yl)methylamino]cyclohexyl]-1H-benzimidazol-2-one
CID 155272731
3-[(3R)-1-(2-ethylbutyl)piperidin-3-yl]-5-methyl-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one
CID 155272782
8-methyl-6-(4-methyl-3-piperidin-4-yloxy-1H-indazol-6-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 148825586
6-(3-cyclohexyl-4-methyl-2H-indazol-6-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 163813257
6-[2-chloro-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)phenyl]-3-(2-oxopiperidin-4-yl)-1H-thieno[3,2-d]pyrimidine-2,4-dione
CID 176878758
6-(7,8-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-(1-methylpiperidin-3-yl)-5-propan-2-yl-1H-benzimidazol-2-one
CID 155272697
6-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-[(3S)-1-methylpiperidin-3-yl]-5-propan-2-yl-1H-benzimidazol-2-one
CID 155272934
7-methyl-3-(1-methylpiperidin-4-yl)-1H-quinazoline-2,4-dione
CID 117261515
6-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-5-methyl-3-[(3R)-1-pentan-3-ylpiperidin-3-yl]-1H-benzimidazol-2-one
CID 155272872
1-(1-methylpiperidin-4-yl)-8-quinolin-3-yl-3H-imidazo[4,5-c][1,5]naphthyridin-2-one
CID 91064337
5-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-piperidin-4-yl-6-propan-2-yl-4H-thieno[3,2-b]pyrrole
CID 164876114

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one?
The IUPAC name of 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one (CID 155272770) is 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one.
What is the SMILES notation for 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one?
The canonical SMILES for 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one is Cc1cc(-c2cc(C)c3ncnn3c2)cc2[nH]c(=O)n(C3CCN(C)CC3)c12.
What is the InChIKey of 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one?
The InChIKey is QQUBZTAWGKSVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-13-8-15(16-9-14(2)20-22-12-23-26(20)11-16)10-18-19(13)27(21(28)24-18)17-4-6-25(3)7-5-17/h8-12,17H,4-7H2,1-3H3,(H,24,28).
What are the key properties of 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one?
4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one has a molecular weight of 376.46 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(1-methylpiperidin-4-yl)-6-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-benzimidazol-2-one is sourced from PubChem (CID 155272770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).