N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride

C16H15ClN2O2 — CID 11231939

IUPACN-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride
SMILESCOc1ccccc1Nc1ncc(-c2ccccc2)o1.Cl
InChIInChI=1S/C16H14N2O2.ClH/c1-19-14-10-6-5-9-13(14)18-16-17-11-15(20-16)12-7-3-2-4-8-12;/h2-11H,1H3,(H,17,18);1H
InChIKeyIHXLWHUWFVFLCY-UHFFFAOYSA-N
MW302.76 g/mol
LogP4.52
Rot. Bonds4

About N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride

N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride (PubChem CID 11231939) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride
PubChem CID11231939
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride
SMILESCOc1ccccc1Nc1ncc(-c2ccccc2)o1.Cl
InChIInChI=1S/C16H14N2O2.ClH/c1-19-14-10-6-5-9-13(14)18-16-17-11-15(20-16)12-7-3-2-4-8-12;/h2-11H,1H3,(H,17,18);1H
InChIKeyIHXLWHUWFVFLCY-UHFFFAOYSA-N
XLogP4.52
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-Diphenyl-2-oxazolamine
CID 5329404
2-[(5-Phenyl-1,3-oxazol-2-yl)amino]benzonitrile
CID 5329843
N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329844
3-[(5-Phenyl-1,3-oxazol-2-yl)amino]benzonitrile
CID 5329845
3-(5-Phenyl-oxazol-2-ylamino)phenylmethanol
CID 5329847
N-(3-methylphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329849
4-[(5-Phenyl-1,3-oxazol-2-yl)amino]benzenesulfonamide
CID 5329850
N-(3,4-dimethoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329852
N-(3,5-dimethoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329853
5-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3-oxazol-2-amine
CID 5329854
2-Anilino-5-aryloxazole 20
CID 5329855
2-Anilino-5-aryloxazole 21
CID 5329856

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride?
The IUPAC name of N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride (CID 11231939) is N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride.
What is the SMILES notation for N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride?
The canonical SMILES for N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride is COc1ccccc1Nc1ncc(-c2ccccc2)o1.Cl.
What is the InChIKey of N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride?
The InChIKey is IHXLWHUWFVFLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2.ClH/c1-19-14-10-6-5-9-13(14)18-16-17-11-15(20-16)12-7-3-2-4-8-12;/h2-11H,1H3,(H,17,18);1H.
What are the key properties of N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride?
N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride has a molecular weight of 302.76 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine;hydrochloride is sourced from PubChem (CID 11231939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).