[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone

C18H15N3O2 — CID 3856051

IUPAC[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone
SMILESNc1cccc(-c2nc(C(=O)N3CCc4ccccc43)co2)c1
InChIInChI=1S/C18H15N3O2/c19-14-6-3-5-13(10-14)17-20-15(11-23-17)18(22)21-9-8-12-4-1-2-7-16(12)21/h1-7,10-11H,8-9,19H2
InChIKeyCNCNKBMLHROAKB-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.13
Rot. Bonds2

About [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone

[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone (PubChem CID 3856051) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone
PubChem CID3856051
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone
SMILESNc1cccc(-c2nc(C(=O)N3CCc4ccccc43)co2)c1
InChIInChI=1S/C18H15N3O2/c19-14-6-3-5-13(10-14)17-20-15(11-23-17)18(22)21-9-8-12-4-1-2-7-16(12)21/h1-7,10-11H,8-9,19H2
InChIKeyCNCNKBMLHROAKB-UHFFFAOYSA-N
XLogP3.13
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone 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

(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
CID 110857028
(5-bromo-2,3-dihydroindol-1-yl)-(2-phenyl-1,3-oxazol-4-yl)methanone
CID 99697107
[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(1,4-diazepan-1-yl)methanone
CID 3857561
methyl 2-(3-aminophenyl)-1,3-oxazole-4-carboxylate
CID 16731543
2,3-dihydroindol-1-yl-(6-methyl-2-pyridinyl)methanone
CID 33315959
[2-(3,4-dichlorophenyl)-1,3-oxazol-4-yl]-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone
CID 84553156
2,3-dihydroindol-1-yl-(1-methyl-5-phenylpyrazol-3-yl)methanone
CID 110336182
2,3-dihydroindol-1-yl-(4-hydrazinyl-2-pyridinyl)methanone
CID 62249581
2,3-dihydroindol-1-yl-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 110856964
2,3-dihydroindol-1-yl(imidazo[1,2-a]pyridin-2-yl)methanone
CID 25341942
2,3-dihydroindol-1-yl-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methanone
CID 50778980
2-(3-aminophenoxy)-1-(2,3-dihydroindol-1-yl)ethanone
CID 61035060

Frequently Asked Questions

What is the IUPAC name of [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone (CID 3856051) is [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone is Nc1cccc(-c2nc(C(=O)N3CCc4ccccc43)co2)c1.
What is the InChIKey of [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is CNCNKBMLHROAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c19-14-6-3-5-13(10-14)17-20-15(11-23-17)18(22)21-9-8-12-4-1-2-7-16(12)21/h1-7,10-11H,8-9,19H2.
What are the key properties of [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone?
[2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 305.34 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-aminophenyl)-1,3-oxazol-4-yl]-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 3856051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).