3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide

C17H15N5O2 — CID 25325404

IUPAC3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
SMILESO=C(CCc1nc2ccccc2[nH]1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C17H15N5O2/c23-16(8-7-15-19-11-3-1-2-4-12(11)20-15)18-10-5-6-13-14(9-10)22-17(24)21-13/h1-6,9H,7-8H2,(H,18,23)(H,19,20)(H2,21,22,24)
InChIKeyZBPQOOUWUDARGC-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.30
Rot. Bonds4

About 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide

3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide (PubChem CID 25325404) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
PubChem CID25325404
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
SMILESO=C(CCc1nc2ccccc2[nH]1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C17H15N5O2/c23-16(8-7-15-19-11-3-1-2-4-12(11)20-15)18-10-5-6-13-14(9-10)22-17(24)21-13/h1-6,9H,7-8H2,(H,18,23)(H,19,20)(H2,21,22,24)
InChIKeyZBPQOOUWUDARGC-UHFFFAOYSA-N
XLogP2.30
TPSA106.43 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

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3-(1H-benzimidazol-2-yl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)propanamide
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ethyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]benzoate
CID 34202274
3-(2-methylphenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 110724040
3-(1H-benzimidazol-2-yl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)propanamide
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3-(1H-benzimidazol-2-yl)-N-(4-imidazol-1-ylphenyl)propanamide
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3-[3-(1H-benzimidazol-2-yl)propanoylamino]-N,N-diethylbenzamide
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N-[6-[3-(1H-benzimidazol-2-yl)propanoylamino]-1,3-benzothiazol-2-yl]benzamide
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Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide?
The IUPAC name of 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide (CID 25325404) is 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide is O=C(CCc1nc2ccccc2[nH]1)Nc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide?
The InChIKey is ZBPQOOUWUDARGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c23-16(8-7-15-19-11-3-1-2-4-12(11)20-15)18-10-5-6-13-14(9-10)22-17(24)21-13/h1-6,9H,7-8H2,(H,18,23)(H,19,20)(H2,21,22,24).
What are the key properties of 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide?
3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide has a molecular weight of 321.34 g/mol, XLogP of 2.30, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide is sourced from PubChem (CID 25325404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).