2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol

C6H10N2OS — CID 130690765

IUPAC2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol
SMILESCc1cc(C(O)CN)sn1
InChIInChI=1S/C6H10N2OS/c1-4-2-6(10-8-4)5(9)3-7/h2,5,9H,3,7H2,1H3
InChIKeyNJRZUFAEBODMKH-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.44
Rot. Bonds2

About 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol

2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol (PubChem CID 130690765) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol
PubChem CID130690765
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol
SMILESCc1cc(C(O)CN)sn1
InChIInChI=1S/C6H10N2OS/c1-4-2-6(10-8-4)5(9)3-7/h2,5,9H,3,7H2,1H3
InChIKeyNJRZUFAEBODMKH-UHFFFAOYSA-N
XLogP0.44
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-Methyl-1,2-thiazol-3-yl)ethanol
CID 45085688
3-Amino-1,1,1-trifluoro-2-(3-methyl-1,2-thiazol-5-yl)propan-2-ol
CID 130638070
(1R)-2,2,2-trifluoro-1-(3-methyl-1,2-thiazol-5-yl)ethanol
CID 130991631
2-Amino-1-(5-decyl-1,2-thiazol-3-yl)propane-1,3-diol
CID 18372918
3-Ethyl-5-isothiazolemethanol
CID 89816508
(5-Ethylisothiazol-3-yl)methanol
CID 164719542
3-(5-Ethyl-1,2-thiazol-3-yl)-3-hydroxy-2-iminopropanimidoyl iodide
CID 166833323
(Z)-2-[(3-ethyl-1,2-thiazol-5-yl)-hydroxymethyl]-3-(methylamino)prop-2-enimidoyl bromide
CID 166836556
2-[3-(Methoxymethyl)-1,2-thiazol-5-yl]ethanamine
CID 82372977
5-(1-Hydroxyethyl)-1,2-thiazole-3-carbonitrile
CID 82416630
2-Amino-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
CID 112489533
3-Amino-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
CID 126985727

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol?
The IUPAC name of 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol (CID 130690765) is 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol.
What is the SMILES notation for 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol?
The canonical SMILES for 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol is Cc1cc(C(O)CN)sn1.
What is the InChIKey of 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol?
The InChIKey is NJRZUFAEBODMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-4-2-6(10-8-4)5(9)3-7/h2,5,9H,3,7H2,1H3.
What are the key properties of 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol?
2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol has a molecular weight of 158.23 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-methyl-1,2-thiazol-5-yl)ethanol is sourced from PubChem (CID 130690765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).