2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol

C22H26N2O2 — CID 23723216

IUPAC2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol
SMILESCc1oc(-c2ccc(-c3ccccc3)cc2)nc1CN(CCO)C(C)C
InChIInChI=1S/C22H26N2O2/c1-16(2)24(13-14-25)15-21-17(3)26-22(23-21)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,16,25H,13-15H2,1-3H3
InChIKeyCHVWMSPMCIIYOG-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.52
Rot. Bonds7

About 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol

2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol (PubChem CID 23723216) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol
PubChem CID23723216
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol
SMILESCc1oc(-c2ccc(-c3ccccc3)cc2)nc1CN(CCO)C(C)C
InChIInChI=1S/C22H26N2O2/c1-16(2)24(13-14-25)15-21-17(3)26-22(23-21)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,16,25H,13-15H2,1-3H3
InChIKeyCHVWMSPMCIIYOG-UHFFFAOYSA-N
XLogP4.52
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol with MolForge

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Related Compounds

Ditazole
CID 29088
2-(((2-(4-Ethylphenyl)-5-methyloxazol-4-yl)methyl)thio)-N-phenethylacetamide
CID 6622273
Dimethyl-POPOP
CID 76491
Oxazole, 2-methyl-4,5-diphenyl-
CID 139703
Phenylpropanoic acid derivative, 56
CID 10164032
Phenylpropanoic acid derivative, 57
CID 10164033
N-{2-[ethyl(phenyl)amino]ethyl}-1-{[2-(4-ethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
CID 3238586
(3R,4S)-4-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-1-phenoxycarbonylpyrrolidine-3-carboxylic acid
CID 10346786
(3E)-2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-3-propoxyiminobutanoic acid
CID 11751301
(3E)-3-methoxyimino-2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]pentanoic acid
CID 25263406
5-Methyl-2-phenyl-4-oxazolecarboxamide
CID 100344
2-(5-Methyl-2-phenyl-4-oxazolyl)ethanol
CID 725585

Frequently Asked Questions

What is the IUPAC name of 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol?
The IUPAC name of 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol (CID 23723216) is 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol is Cc1oc(-c2ccc(-c3ccccc3)cc2)nc1CN(CCO)C(C)C.
What is the InChIKey of 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol?
The InChIKey is CHVWMSPMCIIYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-16(2)24(13-14-25)15-21-17(3)26-22(23-21)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,16,25H,13-15H2,1-3H3.
What are the key properties of 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol?
2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol has a molecular weight of 350.46 g/mol, XLogP of 4.52, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl-propan-2-ylamino]ethanol is sourced from PubChem (CID 23723216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).