N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide

C12H11N3O2 — CID 80566319

IUPACN-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESO=C(Nc1cnoc1)C1CNc2ccccc21
InChIInChI=1S/C12H11N3O2/c16-12(15-8-5-14-17-7-8)10-6-13-11-4-2-1-3-9(10)11/h1-5,7,10,13H,6H2,(H,15,16)
InChIKeyVLRYGGIECSAVKY-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.82
Rot. Bonds2

About N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide

N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide (PubChem CID 80566319) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide
PubChem CID80566319
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESO=C(Nc1cnoc1)C1CNc2ccccc21
InChIInChI=1S/C12H11N3O2/c16-12(15-8-5-14-17-7-8)10-6-13-11-4-2-1-3-9(10)11/h1-5,7,10,13H,6H2,(H,15,16)
InChIKeyVLRYGGIECSAVKY-UHFFFAOYSA-N
XLogP1.82
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyrimidin-5-yl-2,3-dihydro-1H-indole-3-carboxamide
CID 107588629
5-(2,3-dihydro-1H-indole-3-carbonylamino)pyridine-3-carboxylic acid
CID 80563548
N-(3-bromophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80565871
N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76977109
N-[3-(hydroxymethyl)phenyl]-2,3-dihydro-1H-indole-3-carboxamide
CID 80565407
N-(3-fluoro-5-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80567216
N-(2-fluorophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566014
N-(1,2,4-triazin-3-yl)-2,3-dihydro-1H-indole-3-carboxamide
CID 114387742
N-(3-bromo-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80567176
N-[4-(cyanomethyl)phenyl]-2,3-dihydro-1H-indole-3-carboxamide
CID 80564486
N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566409
N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566104

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide?
The IUPAC name of N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide (CID 80566319) is N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide.
What is the SMILES notation for N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide?
The canonical SMILES for N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide is O=C(Nc1cnoc1)C1CNc2ccccc21.
What is the InChIKey of N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide?
The InChIKey is VLRYGGIECSAVKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c16-12(15-8-5-14-17-7-8)10-6-13-11-4-2-1-3-9(10)11/h1-5,7,10,13H,6H2,(H,15,16).
What are the key properties of N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide?
N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide is sourced from PubChem (CID 80566319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).