5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine

C41H34N6O5 — CID 161367496

IUPAC5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine
SMILESCOc1c(-c2cnc(N)o2)ccc2ccccc12.COc1ccc2ccccc2c1-c1cnc(N)o1.Nc1ncc(-c2ccc3ccccc3c2)o1
InChIInChI=1S/2C14H12N2O2.C13H10N2O/c1-17-11-7-6-9-4-2-3-5-10(9)13(11)12-8-16-14(15)18-12;1-17-13-10-5-3-2-4-9(10)6-7-11(13)12-8-16-14(15)18-12;14-13-15-8-12(16-13)11-6-5-9-3-1-2-4-10(9)7-11/h2*2-8H,1H3,(H2,15,16);1-8H,(H2,14,15)
InChIKeyVPZVTMAMMRALSX-UHFFFAOYSA-N
MW690.76 g/mol
LogP9.25
Rot. Bonds5

About 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine

5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine (PubChem CID 161367496) has the molecular formula C41H34N6O5 and a molecular weight of 690.76 g/mol. Its IUPAC name is 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine
PubChem CID161367496
Molecular FormulaC41H34N6O5
Molecular Weight690.76 g/mol
Exact Mass690.26
IUPAC Name5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine
SMILESCOc1c(-c2cnc(N)o2)ccc2ccccc12.COc1ccc2ccccc2c1-c1cnc(N)o1.Nc1ncc(-c2ccc3ccccc3c2)o1
InChIInChI=1S/2C14H12N2O2.C13H10N2O/c1-17-11-7-6-9-4-2-3-5-10(9)13(11)12-8-16-14(15)18-12;1-17-13-10-5-3-2-4-9(10)6-7-11(13)12-8-16-14(15)18-12;14-13-15-8-12(16-13)11-6-5-9-3-1-2-4-10(9)7-11/h2*2-8H,1H3,(H2,15,16);1-8H,(H2,14,15)
InChIKeyVPZVTMAMMRALSX-UHFFFAOYSA-N
XLogP9.25
TPSA174.61 Ų
H-Bond Donors3
H-Bond Acceptors11
Rotatable Bonds5
Heavy Atoms52
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500690.76
LogP ≤ 59.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1011

Analyze 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-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

5-(3-ethyl-4-methoxyphenyl)-1,3-oxazol-2-amine
CID 82285421
4-(2-methoxynaphthalen-1-yl)-1,2-oxazol-5-amine
CID 117353085
[3-methoxy-4-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]-trimethylsilane
CID 175847366
2-(2-methoxynaphthalen-1-yl)chromen-4-one
CID 71394280
2-methoxy-1-(2-methoxy-3-naphthalen-2-ylnaphthalen-1-yl)-3-naphthalen-2-ylnaphthalene
CID 10531028
5-[2-methoxy-5-(2-methoxyphenyl)phenyl]-1,3-oxazol-2-amine;2,2,2-trifluoroacetic acid
CID 121231725
2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
CID 11017918
3-(5-naphthalen-2-yl-1,3-oxazol-2-yl)propan-1-amine
CID 65179310
2-(2-methoxynaphthalen-1-yl)pyrazine
CID 102284148
2-naphthalen-2-yl-1-(2-naphthalen-2-ylnaphthalen-1-yl)naphthalene
CID 10744186
2-[6-methoxy-5-[2-methoxy-6-(5-phenyl-1,3,4-oxadiazol-2-yl)naphthalen-1-yl]naphthalen-2-yl]-5-phenyl-1,3,4-oxadiazole
CID 59815296
barium(2+);bis(1-(2-methoxynaphthalen-1-yl)naphthalen-2-olate)
CID 10952722

Frequently Asked Questions

What is the IUPAC name of 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine?
The IUPAC name of 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine (CID 161367496) is 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine?
The canonical SMILES for 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine is COc1c(-c2cnc(N)o2)ccc2ccccc12.COc1ccc2ccccc2c1-c1cnc(N)o1.Nc1ncc(-c2ccc3ccccc3c2)o1.
What is the InChIKey of 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine?
The InChIKey is VPZVTMAMMRALSX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H12N2O2.C13H10N2O/c1-17-11-7-6-9-4-2-3-5-10(9)13(11)12-8-16-14(15)18-12;1-17-13-10-5-3-2-4-9(10)6-7-11(13)12-8-16-14(15)18-12;14-13-15-8-12(16-13)11-6-5-9-3-1-2-4-10(9)7-11/h2*2-8H,1H3,(H2,15,16);1-8H,(H2,14,15).
What are the key properties of 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine?
5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine has a molecular weight of 690.76 g/mol, XLogP of 9.25, 5 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methoxynaphthalen-2-yl)-1,3-oxazol-2-amine;5-(2-methoxynaphthalen-1-yl)-1,3-oxazol-2-amine;5-naphthalen-2-yl-1,3-oxazol-2-amine is sourced from PubChem (CID 161367496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).