(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone

C12H11N3O2 — CID 110857028

IUPAC(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESNc1nc(C(=O)N2CCc3ccccc32)co1
InChIInChI=1S/C12H11N3O2/c13-12-14-9(7-17-12)11(16)15-6-5-8-3-1-2-4-10(8)15/h1-4,7H,5-6H2,(H2,13,14)
InChIKeyCHJFLTYEGITVNK-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.46
Rot. Bonds1

About (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone

(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 110857028) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID110857028
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC Name(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESNc1nc(C(=O)N2CCc3ccccc32)co1
InChIInChI=1S/C12H11N3O2/c13-12-14-9(7-17-12)11(16)15-6-5-8-3-1-2-4-10(8)15/h1-4,7H,5-6H2,(H2,13,14)
InChIKeyCHJFLTYEGITVNK-UHFFFAOYSA-N
XLogP1.46
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone
CID 3856051
2,3-dihydroindol-1-yl-(6-methyl-2-pyridinyl)methanone
CID 33315959
2,3-dihydroindol-1-yl(imidazo[1,2-a]pyridin-2-yl)methanone
CID 25341942
(5-bromo-2,3-dihydroindol-1-yl)-(2-phenyl-1,3-oxazol-4-yl)methanone
CID 99697107
2,3-dihydroindol-1-yl-(1-methyl-5-phenylpyrazol-3-yl)methanone
CID 110336182
(2-amino-1,3-oxazol-4-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 110854582
(3-aminothiophen-2-yl)-(2,3-dihydroindol-1-yl)methanone
CID 61090033
6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxylic acid
CID 43558372
(2-chlorofuran-3-yl)-(2,3-dihydroindol-1-yl)methanone
CID 106685283
2,3-dihydroindol-1-yl-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 110856964
2,3-dihydroindol-1-yl-(5-hydrazinyl-2-pyridinyl)methanone
CID 104642375
(5-anilino-2-pyridinyl)-(2,3-dihydroindol-1-yl)methanone
CID 109197059

Frequently Asked Questions

What is the IUPAC name of (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone (CID 110857028) is (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone is Nc1nc(C(=O)N2CCc3ccccc32)co1.
What is the InChIKey of (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is CHJFLTYEGITVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c13-12-14-9(7-17-12)11(16)15-6-5-8-3-1-2-4-10(8)15/h1-4,7H,5-6H2,(H2,13,14).
What are the key properties of (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone?
(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 229.24 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 110857028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).