2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride

C10H19ClN2O2S — CID 67596243

IUPAC2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride
SMILESCc1csc(C(O)COCCN(C)C)n1.Cl
InChIInChI=1S/C10H18N2O2S.ClH/c1-8-7-15-10(11-8)9(13)6-14-5-4-12(2)3;/h7,9,13H,4-6H2,1-3H3;1H
InChIKeyDNLAAAMLHAKPFW-UHFFFAOYSA-N
MW266.79 g/mol
LogP1.48
Rot. Bonds6

About 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride

2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride (PubChem CID 67596243) has the molecular formula C10H19ClN2O2S and a molecular weight of 266.79 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride
PubChem CID67596243
Molecular FormulaC10H19ClN2O2S
Molecular Weight266.79 g/mol
Exact Mass266.09
IUPAC Name2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride
SMILESCc1csc(C(O)COCCN(C)C)n1.Cl
InChIInChI=1S/C10H18N2O2S.ClH/c1-8-7-15-10(11-8)9(13)6-14-5-4-12(2)3;/h7,9,13H,4-6H2,1-3H3;1H
InChIKeyDNLAAAMLHAKPFW-UHFFFAOYSA-N
XLogP1.48
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.79
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride (CID 67596243) is 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride is Cc1csc(C(O)COCCN(C)C)n1.Cl.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride?
The InChIKey is DNLAAAMLHAKPFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S.ClH/c1-8-7-15-10(11-8)9(13)6-14-5-4-12(2)3;/h7,9,13H,4-6H2,1-3H3;1H.
What are the key properties of 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride?
2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride has a molecular weight of 266.79 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanol;hydrochloride is sourced from PubChem (CID 67596243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).