ethane;5-phenyl-1,2-oxazol-3-amine

C11H14N2O — CID 145311661

IUPACethane;5-phenyl-1,2-oxazol-3-amine
SMILESCC.Nc1cc(-c2ccccc2)on1
InChIInChI=1S/C9H8N2O.C2H6/c10-9-6-8(12-11-9)7-4-2-1-3-5-7;1-2/h1-6H,(H2,10,11);1-2H3
InChIKeyHIOOEBMMJFIXQJ-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.95
Rot. Bonds1

About ethane;5-phenyl-1,2-oxazol-3-amine

ethane;5-phenyl-1,2-oxazol-3-amine (PubChem CID 145311661) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is ethane;5-phenyl-1,2-oxazol-3-amine.

Molecular Properties

Compound Nameethane;5-phenyl-1,2-oxazol-3-amine
PubChem CID145311661
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Nameethane;5-phenyl-1,2-oxazol-3-amine
SMILESCC.Nc1cc(-c2ccccc2)on1
InChIInChI=1S/C9H8N2O.C2H6/c10-9-6-8(12-11-9)7-4-2-1-3-5-7;1-2/h1-6H,(H2,10,11);1-2H3
InChIKeyHIOOEBMMJFIXQJ-UHFFFAOYSA-N
XLogP2.95
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;5-phenyl-1,2-oxazol-3-amine 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

ethane;5-phenyl-1,2-oxazole-3-carbaldehyde
CID 144767511
5-(4-propan-2-yloxyphenyl)-1,2-oxazol-3-amine
CID 82472063
5-(3-pentan-3-ylphenyl)-1,2-oxazol-3-amine
CID 117332870
5-[4-(diethylamino)phenyl]-1,2-oxazol-3-amine
CID 117334620
5-(4-ethylsulfanylphenyl)-1,2-oxazol-3-amine
CID 82472660
5-(4-ethoxyphenyl)-1,2-oxazol-3-amine
CID 27242742
5-(1-methylpyrrol-3-yl)-1,2-oxazol-3-amine
CID 82467912
ethane;1-(5-phenyl-1,2-oxazol-3-yl)ethanone
CID 145281683
5-(5-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 114823937
3-methylsulfanyl-5-phenyl-1,2-oxazole
CID 5325023
5-(2-propan-2-ylphenyl)-1,2-oxazol-3-amine
CID 117290994
5-[3-(triazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326394

Frequently Asked Questions

What is the IUPAC name of ethane;5-phenyl-1,2-oxazol-3-amine?
The IUPAC name of ethane;5-phenyl-1,2-oxazol-3-amine (CID 145311661) is ethane;5-phenyl-1,2-oxazol-3-amine.
What is the SMILES notation for ethane;5-phenyl-1,2-oxazol-3-amine?
The canonical SMILES for ethane;5-phenyl-1,2-oxazol-3-amine is CC.Nc1cc(-c2ccccc2)on1.
What is the InChIKey of ethane;5-phenyl-1,2-oxazol-3-amine?
The InChIKey is HIOOEBMMJFIXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O.C2H6/c10-9-6-8(12-11-9)7-4-2-1-3-5-7;1-2/h1-6H,(H2,10,11);1-2H3.
What are the key properties of ethane;5-phenyl-1,2-oxazol-3-amine?
ethane;5-phenyl-1,2-oxazol-3-amine has a molecular weight of 190.25 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-phenyl-1,2-oxazol-3-amine is sourced from PubChem (CID 145311661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).