4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine

C16H14N2OS — CID 77040091

IUPAC4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine
SMILESCOc1ccc2cc(C=Cc3csc(N)n3)ccc2c1
InChIInChI=1S/C16H14N2OS/c1-19-15-7-5-12-8-11(2-4-13(12)9-15)3-6-14-10-20-16(17)18-14/h2-10H,1H3,(H2,17,18)
InChIKeyKPOSPDGTBOOZJV-UHFFFAOYSA-N
MW282.37 g/mol
LogP4.06
Rot. Bonds3

About 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine

4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine (PubChem CID 77040091) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine
PubChem CID77040091
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine
SMILESCOc1ccc2cc(C=Cc3csc(N)n3)ccc2c1
InChIInChI=1S/C16H14N2OS/c1-19-15-7-5-12-8-11(2-4-13(12)9-15)3-6-14-10-20-16(17)18-14/h2-10H,1H3,(H2,17,18)
InChIKeyKPOSPDGTBOOZJV-UHFFFAOYSA-N
XLogP4.06
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(2-fluoro-4-methoxyphenyl)ethenyl]-1,3-thiazol-2-amine
CID 77039954
4-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-1,3-thiazol-2-amine
CID 77039909
4-[2-(3,4-dimethylphenyl)ethenyl]-1,3-thiazol-2-amine
CID 77040042
4-[2-(2,6-difluoro-4-methoxyphenyl)ethenyl]-1,3-thiazol-2-amine
CID 77040047
4-[2-[4-(dimethylamino)phenyl]ethenyl]-1,3-thiazol-2-amine
CID 164769574
4-[(E)-2-[3-bromo-4-(2-methoxyethoxy)phenyl]ethenyl]-1,3-thiazol-2-amine
CID 104658438
4-[(E)-2-(3-bromo-4-ethoxyphenyl)ethenyl]-1,3-thiazol-2-amine
CID 104658435
4-[2-(2-methoxy-5-methylphenyl)ethenyl]-1,3-thiazol-2-amine
CID 77040002
4-[2-[4-(2-methylbutan-2-yl)phenyl]ethenyl]-1,3-thiazol-2-amine
CID 77120064
4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-amine
CID 675262
6-methoxy-2-[(E)-2-naphthalen-2-ylethenyl]quinolin-8-amine
CID 10616121
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307

Frequently Asked Questions

What is the IUPAC name of 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine (CID 77040091) is 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine is COc1ccc2cc(C=Cc3csc(N)n3)ccc2c1.
What is the InChIKey of 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine?
The InChIKey is KPOSPDGTBOOZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-19-15-7-5-12-8-11(2-4-13(12)9-15)3-6-14-10-20-16(17)18-14/h2-10H,1H3,(H2,17,18).
What are the key properties of 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine?
4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine has a molecular weight of 282.37 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-methoxynaphthalen-2-yl)ethenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 77040091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).