N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide

C17H15N5O2 — CID 71943300

IUPACN-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
SMILESCn1c(=O)n(CC(=O)Nc2ccc3[nH]ncc3c2)c2ccccc21
InChIInChI=1S/C17H15N5O2/c1-21-14-4-2-3-5-15(14)22(17(21)24)10-16(23)19-12-6-7-13-11(8-12)9-18-20-13/h2-9H,10H2,1H3,(H,18,20)(H,19,23)
InChIKeyIJVHFLCKSTVYMS-UHFFFAOYSA-N
MW321.34 g/mol
LogP1.86
Rot. Bonds3

About N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide

N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide (PubChem CID 71943300) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
PubChem CID71943300
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC NameN-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
SMILESCn1c(=O)n(CC(=O)Nc2ccc3[nH]ncc3c2)c2ccccc21
InChIInChI=1S/C17H15N5O2/c1-21-14-4-2-3-5-15(14)22(17(21)24)10-16(23)19-12-6-7-13-11(8-12)9-18-20-13/h2-9H,10H2,1H3,(H,18,20)(H,19,23)
InChIKeyIJVHFLCKSTVYMS-UHFFFAOYSA-N
XLogP1.86
TPSA84.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(4-phenylphenyl)acetamide
CID 24609349
N-(2-methyl-1,3-benzoxazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
CID 17472904
3-chloro-N-(1H-indazol-5-yl)propanamide
CID 17164503
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-[3-[(R)-methylsulfinyl]phenyl]acetamide
CID 95619904
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-pyridin-2-ylacetamide
CID 18142520
N-[3-(methoxymethyl)phenyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
CID 32639195
2-[[2-(3-methyl-2-oxobenzimidazol-1-yl)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 55495817
2-(4-aminotriazol-2-yl)-N-(1H-indazol-5-yl)acetamide
CID 112527257
N-(1H-indazol-5-yl)-4,4-dimethylpentanamide
CID 155236090
N-naphthalen-2-yl-1H-indazole-5-carboxamide
CID 69422881
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide
CID 55951935
anisole;N-(1H-indazol-5-yl)-2-(methylamino)acetamide
CID 142520969

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide?
The IUPAC name of N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide (CID 71943300) is N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide is Cn1c(=O)n(CC(=O)Nc2ccc3[nH]ncc3c2)c2ccccc21.
What is the InChIKey of N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide?
The InChIKey is IJVHFLCKSTVYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-21-14-4-2-3-5-15(14)22(17(21)24)10-16(23)19-12-6-7-13-11(8-12)9-18-20-13/h2-9H,10H2,1H3,(H,18,20)(H,19,23).
What are the key properties of N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide?
N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide has a molecular weight of 321.34 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-yl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide is sourced from PubChem (CID 71943300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).