N-(3-ethoxyphenyl)-1,3-thiazol-2-amine

C11H12N2OS — CID 86645028

IUPACN-(3-ethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCOc1cccc(Nc2nccs2)c1
InChIInChI=1S/C11H12N2OS/c1-2-14-10-5-3-4-9(8-10)13-11-12-6-7-15-11/h3-8H,2H2,1H3,(H,12,13)
InChIKeyOIORNBKXBHULNJ-UHFFFAOYSA-N
MW220.30 g/mol
LogP3.29
Rot. Bonds4

About N-(3-ethoxyphenyl)-1,3-thiazol-2-amine

N-(3-ethoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 86645028) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-1,3-thiazol-2-amine
PubChem CID86645028
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC NameN-(3-ethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCOc1cccc(Nc2nccs2)c1
InChIInChI=1S/C11H12N2OS/c1-2-14-10-5-3-4-9(8-10)13-11-12-6-7-15-11/h3-8H,2H2,1H3,(H,12,13)
InChIKeyOIORNBKXBHULNJ-UHFFFAOYSA-N
XLogP3.29
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[4-(pyridin-4-yloxy)phenyl]-1,3-thiazol-2-amine
CID 16068631
5-bromo-N-(3-methoxyphenyl)-1,3-thiazol-2-amine
CID 16068639
2-[4-(4-Methoxyphenyl)piperazin-1-yl]-1,3-thiazole
CID 2456357
N-(3-((2-Chloro-5-thiazolyl)methoxy)phenyl)acetamide
CID 2764068
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 6462201
N-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]thiazol-2-amine
CID 15956092
2-(3-Methylbut-2-enoxy)-4-(thiazol-2-ylamino)benzonitrile
CID 15956096
(5-Bromo-thiazol-2-yl)-(4-methoxy-phenyl)-amine
CID 12348632
5-bromo-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 16068742
5-bromo-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine
CID 16068854
2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(1,3-thiazol-2-yl)acetamide
CID 866705
(4-Allyloxy-benzyl)-thiazol-2-yl-amine
CID 2215540

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(3-ethoxyphenyl)-1,3-thiazol-2-amine (CID 86645028) is N-(3-ethoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3-ethoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(3-ethoxyphenyl)-1,3-thiazol-2-amine is CCOc1cccc(Nc2nccs2)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is OIORNBKXBHULNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c1-2-14-10-5-3-4-9(8-10)13-11-12-6-7-15-11/h3-8H,2H2,1H3,(H,12,13).
What are the key properties of N-(3-ethoxyphenyl)-1,3-thiazol-2-amine?
N-(3-ethoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 220.30 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 86645028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).