3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine

C15H14N2O3 — CID 117428855

IUPAC3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine
SMILESCOc1ccc2ccc(OC)c(-c3cc(N)on3)c2c1
InChIInChI=1S/C15H14N2O3/c1-18-10-5-3-9-4-6-13(19-2)15(11(9)7-10)12-8-14(16)20-17-12/h3-8H,16H2,1-2H3
InChIKeyNZVJYLMXHBSIDW-UHFFFAOYSA-N
MW270.29 g/mol
LogP3.09
Rot. Bonds3

About 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine

3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine (PubChem CID 117428855) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine
PubChem CID117428855
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine
SMILESCOc1ccc2ccc(OC)c(-c3cc(N)on3)c2c1
InChIInChI=1S/C15H14N2O3/c1-18-10-5-3-9-4-6-13(19-2)15(11(9)7-10)12-8-14(16)20-17-12/h3-8H,16H2,1-2H3
InChIKeyNZVJYLMXHBSIDW-UHFFFAOYSA-N
XLogP3.09
TPSA70.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2,6-dimethoxy-3-methylphenyl)-1,2-oxazol-5-amine
CID 117340342
3-(2-bromo-4,6-dimethoxyphenyl)-1,2-oxazol-5-amine
CID 117481559
3-(6-methoxy-1H-indol-2-yl)-1,2-oxazol-5-amine
CID 136985615
3-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-1,2-oxazol-5-amine
CID 117414895
2-(5-amino-1,2-oxazol-3-yl)-3-bromo-6-methoxyphenol
CID 136931170
3-[2-methoxy-6-(trifluoromethyl)phenyl]-1,2-oxazol-5-amine
CID 117398617
7-methoxy-1-(7-methoxy-2-methylnaphthalen-1-yl)-2-methylnaphthalene
CID 20715432
3-(5-chloro-2,3-dimethoxyphenyl)-1,2-oxazol-5-amine
CID 117389651
3-[4-bromo-2-methoxy-6-(methoxymethyl)phenyl]-1,2-oxazol-5-amine
CID 117498194
3-(2,5-dimethoxy-3,4-dimethylphenyl)-1,2-oxazol-5-amine
CID 117373551
3-(2-methoxy-3,4,6-trimethylphenyl)-1,2-oxazol-5-amine
CID 115112351
3-(5-amino-1,2-oxazol-3-yl)-2,4-difluoro-5-methoxyphenol
CID 117356931

Frequently Asked Questions

What is the IUPAC name of 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine (CID 117428855) is 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine is COc1ccc2ccc(OC)c(-c3cc(N)on3)c2c1.
What is the InChIKey of 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine?
The InChIKey is NZVJYLMXHBSIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-18-10-5-3-9-4-6-13(19-2)15(11(9)7-10)12-8-14(16)20-17-12/h3-8H,16H2,1-2H3.
What are the key properties of 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine?
3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine has a molecular weight of 270.29 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,7-dimethoxynaphthalen-1-yl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117428855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).