N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide

C15H10N4O3 — CID 110662054

IUPACN-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2nc[nH]c2c1
InChIInChI=1S/C15H10N4O3/c20-14(8-1-3-10-12(5-8)17-7-16-10)18-9-2-4-11-13(6-9)22-15(21)19-11/h1-7H,(H,16,17)(H,18,20)(H,19,21)
InChIKeyOBPPMUXUJFYBMD-UHFFFAOYSA-N
MW294.27 g/mol
LogP2.25
Rot. Bonds2

About N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide

N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide (PubChem CID 110662054) has the molecular formula C15H10N4O3 and a molecular weight of 294.27 g/mol. Its IUPAC name is N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide
PubChem CID110662054
Molecular FormulaC15H10N4O3
Molecular Weight294.27 g/mol
Exact Mass294.08
IUPAC NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2nc[nH]c2c1
InChIInChI=1S/C15H10N4O3/c20-14(8-1-3-10-12(5-8)17-7-16-10)18-9-2-4-11-13(6-9)22-15(21)19-11/h1-7H,(H,16,17)(H,18,20)(H,19,21)
InChIKeyOBPPMUXUJFYBMD-UHFFFAOYSA-N
XLogP2.25
TPSA103.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.27
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide
CID 112523027
N-[4-[4-(3H-benzimidazole-5-carbonylamino)anilino]phenyl]-3H-benzimidazole-5-carboxamide
CID 67686736
4-bromo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)benzamide
CID 50797084
N-quinoxalin-6-yl-3H-benzimidazole-5-carboxamide
CID 110743788
N-(4-hydroxyphenyl)-3H-benzimidazole-5-carboxamide
CID 28739583
2-oxo-N-pyrimidin-2-yl-3H-1,3-benzoxazole-6-carboxamide
CID 110766430
N-(3-acetamidophenyl)-3H-benzimidazole-5-carboxamide
CID 27259059
4-benzamido-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38468547
N-(3-carbamoylphenyl)-3H-benzimidazole-5-carboxamide
CID 60630265
N-(3-chloro-4-hydroxyphenyl)-3H-benzimidazole-5-carboxamide
CID 64788874
methyl 3-[(2-oxo-3H-1,3-benzoxazole-6-carbonyl)amino]benzoate
CID 110766421
N-(3-chlorophenyl)-3H-benzimidazole-5-carboxamide
CID 18847548

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide (CID 110662054) is N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide is O=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2nc[nH]c2c1.
What is the InChIKey of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide?
The InChIKey is OBPPMUXUJFYBMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O3/c20-14(8-1-3-10-12(5-8)17-7-16-10)18-9-2-4-11-13(6-9)22-15(21)19-11/h1-7H,(H,16,17)(H,18,20)(H,19,21).
What are the key properties of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide?
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide has a molecular weight of 294.27 g/mol, XLogP of 2.25, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 110662054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).