2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide

C17H15N5O2 — CID 58188619

IUPAC2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide
SMILESNC(=O)c1ccc2nc(N3CCN(c4ccccc4)C3=O)[nH]c2c1
InChIInChI=1S/C17H15N5O2/c18-15(23)11-6-7-13-14(10-11)20-16(19-13)22-9-8-21(17(22)24)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2,18,23)(H,19,20)
InChIKeyCHSMXPLGPYKKPE-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.11
Rot. Bonds3

About 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide

2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide (PubChem CID 58188619) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide
PubChem CID58188619
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide
SMILESNC(=O)c1ccc2nc(N3CCN(c4ccccc4)C3=O)[nH]c2c1
InChIInChI=1S/C17H15N5O2/c18-15(23)11-6-7-13-14(10-11)20-16(19-13)22-9-8-21(17(22)24)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2,18,23)(H,19,20)
InChIKeyCHSMXPLGPYKKPE-UHFFFAOYSA-N
XLogP2.11
TPSA95.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide?
The IUPAC name of 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide (CID 58188619) is 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide?
The canonical SMILES for 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide is NC(=O)c1ccc2nc(N3CCN(c4ccccc4)C3=O)[nH]c2c1.
What is the InChIKey of 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide?
The InChIKey is CHSMXPLGPYKKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c18-15(23)11-6-7-13-14(10-11)20-16(19-13)22-9-8-21(17(22)24)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2,18,23)(H,19,20).
What are the key properties of 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide?
2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide has a molecular weight of 321.34 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-3-phenylimidazolidin-1-yl)-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 58188619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).