4-(4-ethoxyphenyl)-1,3-thiazol-2-amine

C11H12N2OS — CID 613217

IUPAC4-(4-ethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(-c2csc(N)n2)cc1
InChIInChI=1S/C11H12N2OS/c1-2-14-9-5-3-8(4-6-9)10-7-15-11(12)13-10/h3-7H,2H2,1H3,(H2,12,13)
InChIKeyDBVFYWQXVNAKCZ-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.79
Rot. Bonds3

About 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine

4-(4-ethoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 613217) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-1,3-thiazol-2-amine
PubChem CID613217
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name4-(4-ethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(-c2csc(N)n2)cc1
InChIInChI=1S/C11H12N2OS/c1-2-14-9-5-3-8(4-6-9)10-7-15-11(12)13-10/h3-7H,2H2,1H3,(H2,12,13)
InChIKeyDBVFYWQXVNAKCZ-UHFFFAOYSA-N
XLogP2.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-4-(4-methoxyphenyl)thiazole
CID 159644
4-(2-Amino-1,3-thiazol-4-yl)phenol
CID 346926
4-(4-Phenoxy-phenyl)-thiazol-2-ylamine
CID 780598
T16AInh-A01
CID 135460621
4-Benzo(1,3)dioxol-5-yl-thiazol-2-ylamine
CID 727580
4H-chromeno(4,3-d)(1,3)thiazol-2-amine
CID 1112324
Tioxamast
CID 68927
4-(3,4-Dimethoxyphenyl)-1,3-thiazol-2-amine
CID 332397
4-(2-Methoxy-phenyl)-thiazol-2-ylamine
CID 735252
4-(2,3-Dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-amine
CID 2758374
4-(3-Fluoro-4-methoxyphenyl)-2-thiazolamine
CID 2759006
4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2-amine
CID 613228

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine (CID 613217) is 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine is CCOc1ccc(-c2csc(N)n2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is DBVFYWQXVNAKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c1-2-14-9-5-3-8(4-6-9)10-7-15-11(12)13-10/h3-7H,2H2,1H3,(H2,12,13).
What are the key properties of 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine?
4-(4-ethoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 220.30 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 613217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).