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

C16H11N3O3 — CID 112523027

IUPACN-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H11N3O3/c20-15(10-1-3-12-9(7-10)5-6-17-12)18-11-2-4-13-14(8-11)22-16(21)19-13/h1-8,17H,(H,18,20)(H,19,21)
InChIKeyQGHNRYIDENVOLW-UHFFFAOYSA-N
MW293.28 g/mol
LogP2.85
Rot. Bonds2

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

N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide (PubChem CID 112523027) has the molecular formula C16H11N3O3 and a molecular weight of 293.28 g/mol. Its IUPAC name is N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide
PubChem CID112523027
Molecular FormulaC16H11N3O3
Molecular Weight293.28 g/mol
Exact Mass293.08
IUPAC NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H11N3O3/c20-15(10-1-3-12-9(7-10)5-6-17-12)18-11-2-4-13-14(8-11)22-16(21)19-13/h1-8,17H,(H,18,20)(H,19,21)
InChIKeyQGHNRYIDENVOLW-UHFFFAOYSA-N
XLogP2.85
TPSA90.89 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.28
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)benzamide
CID 50797084
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-benzimidazole-5-carboxamide
CID 110662054
N-(4-methoxyphenyl)-2-oxo-3H-1,3-benzoxazole-6-carboxamide
CID 110766402
N-(3,4-difluorophenyl)-1H-indole-5-carboxamide
CID 63718780
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 110616378
N-(3-chlorophenyl)-1H-indole-5-carboxamide
CID 55230182
methyl 3-[(2-oxo-3H-1,3-benzoxazole-6-carbonyl)amino]benzoate
CID 110766421
2-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)propanamide
CID 115175381
2-hydroxy-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
CID 83820376
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-2-sulfanylacetamide
CID 115166967
2-oxo-N-pyrimidin-2-yl-3H-1,3-benzoxazole-6-carboxamide
CID 110766430
N-(1H-indol-5-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61250452

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide?
The IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide (CID 112523027) is N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide is O=C(Nc1ccc2[nH]c(=O)oc2c1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide?
The InChIKey is QGHNRYIDENVOLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O3/c20-15(10-1-3-12-9(7-10)5-6-17-12)18-11-2-4-13-14(8-11)22-16(21)19-13/h1-8,17H,(H,18,20)(H,19,21).
What are the key properties of N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide?
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide has a molecular weight of 293.28 g/mol, XLogP of 2.85, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide is sourced from PubChem (CID 112523027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).