2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine

C11H12N2OS — CID 141050819

IUPAC2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine
SMILESNCCOc1ccc(-c2ccns2)cc1
InChIInChI=1S/C11H12N2OS/c12-6-8-14-10-3-1-9(2-4-10)11-5-7-13-15-11/h1-5,7H,6,8,12H2
InChIKeyVQKSOJMTEVNMAA-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.15
Rot. Bonds4

About 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine

2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine (PubChem CID 141050819) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine.

Molecular Properties

Compound Name2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine
PubChem CID141050819
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine
SMILESNCCOc1ccc(-c2ccns2)cc1
InChIInChI=1S/C11H12N2OS/c12-6-8-14-10-3-1-9(2-4-10)11-5-7-13-15-11/h1-5,7H,6,8,12H2
InChIKeyVQKSOJMTEVNMAA-UHFFFAOYSA-N
XLogP2.15
TPSA48.14 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 ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
2-[4-(2-methyl-1H-imidazol-5-yl)phenoxy]ethanamine
CID 12986051
2-[4-[5,8,11,20-tetrakis[4-(2-aminoethoxy)phenyl]-2-hexacyclo[11.5.2.04,17.07,16.010,15.014,18]icosa-1(19),2,4(17),5,7,9,11,13(20),14(18),15-decaenyl]phenoxy]ethanamine
CID 176747721
3-[4-(3-aminopropoxy)phenoxy]propan-1-amine
CID 3650737
3-[4-(2-aminoethoxy)phenyl]-1H-pyridazin-6-one
CID 14884403
2-[4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]phenoxy]ethanamine
CID 18523680
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;hydrochloride
CID 171705519
3-[4-(1,2,4,5-tetrazin-3-yl)phenoxy]propan-1-amine;hydrochloride
CID 170905342
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrochloride
CID 88770124
N-[4-(2-aminoethoxy)phenyl]pyridazin-3-amine
CID 113386764
2-[4-(6-phenylmethoxy-1-benzothiophen-2-yl)phenoxy]ethanamine
CID 57244323
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrate;hydrochloride
CID 45260071

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine?
The IUPAC name of 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine (CID 141050819) is 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine.
What is the SMILES notation for 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine?
The canonical SMILES for 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine is NCCOc1ccc(-c2ccns2)cc1.
What is the InChIKey of 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine?
The InChIKey is VQKSOJMTEVNMAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c12-6-8-14-10-3-1-9(2-4-10)11-5-7-13-15-11/h1-5,7H,6,8,12H2.
What are the key properties of 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine?
2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine has a molecular weight of 220.30 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,2-thiazol-5-yl)phenoxy]ethanamine is sourced from PubChem (CID 141050819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).