5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one

C13H14N2O3 — CID 102711392

IUPAC5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)N3CCCCO3)ccc2N1
InChIInChI=1S/C13H14N2O3/c16-12-8-10-7-9(3-4-11(10)14-12)13(17)15-5-1-2-6-18-15/h3-4,7H,1-2,5-6,8H2,(H,14,16)
InChIKeyBHRDLRXZAVURGX-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.35
Rot. Bonds1

About 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one

5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one (PubChem CID 102711392) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one
PubChem CID102711392
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)N3CCCCO3)ccc2N1
InChIInChI=1S/C13H14N2O3/c16-12-8-10-7-9(3-4-11(10)14-12)13(17)15-5-1-2-6-18-15/h3-4,7H,1-2,5-6,8H2,(H,14,16)
InChIKeyBHRDLRXZAVURGX-UHFFFAOYSA-N
XLogP1.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-oxo-1,3-dihydroindole-5-carbonyl)piperazine-2,6-dione
CID 102712522
(2S)-1-(2-oxo-1,3-dihydroindole-5-carbonyl)pyrrolidine-2-carboxylic acid
CID 96669399
5-(thiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
CID 113225087
5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-1,3-dihydroindol-2-one
CID 110800434
5-(3,6-dihydro-2H-pyridine-1-carbonyl)-1,3-dihydroindol-2-one
CID 113356774
5-(cyclopentanecarbonyl)-1,3-dihydroindol-2-one
CID 43160619
5-(3-hydroxy-3-methylpiperidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 103878855
5-(cyclooctanecarbonyl)-1,3-dihydroindol-2-one
CID 65018582
5-(oxolane-2-carbonyl)-1,3-dihydroindol-2-one
CID 43160614
1-(2-oxo-1,3-dihydroindole-5-carbonyl)piperazine-2-carboxylic acid
CID 102711591
5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one
CID 166373053
5-(4-ethylsulfonyl-1,4-diazepane-1-carbonyl)-1,3-dihydroindol-2-one
CID 110810080

Frequently Asked Questions

What is the IUPAC name of 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one (CID 102711392) is 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(C(=O)N3CCCCO3)ccc2N1.
What is the InChIKey of 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one?
The InChIKey is BHRDLRXZAVURGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c16-12-8-10-7-9(3-4-11(10)14-12)13(17)15-5-1-2-6-18-15/h3-4,7H,1-2,5-6,8H2,(H,14,16).
What are the key properties of 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one?
5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one has a molecular weight of 246.27 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 102711392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).