2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol

C7H12N2OS — CID 65169269

IUPAC2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol
SMILESCc1nc(NCCO)sc1C
InChIInChI=1S/C7H12N2OS/c1-5-6(2)11-7(9-5)8-3-4-10/h10H,3-4H2,1-2H3,(H,8,9)
InChIKeyWFDDXLYAFSELPR-UHFFFAOYSA-N
MW172.25 g/mol
LogP1.16
Rot. Bonds3

About 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol

2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol (PubChem CID 65169269) has the molecular formula C7H12N2OS and a molecular weight of 172.25 g/mol. Its IUPAC name is 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol
PubChem CID65169269
Molecular FormulaC7H12N2OS
Molecular Weight172.25 g/mol
Exact Mass172.07
IUPAC Name2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol
SMILESCc1nc(NCCO)sc1C
InChIInChI=1S/C7H12N2OS/c1-5-6(2)11-7(9-5)8-3-4-10/h10H,3-4H2,1-2H3,(H,8,9)
InChIKeyWFDDXLYAFSELPR-UHFFFAOYSA-N
XLogP1.16
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,5-dimethyl-1,3-thiazol-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 60642086
N-(4,5-dimethyl-1,3-thiazol-2-yl)-N',N'-diethylpropane-1,3-diamine
CID 65169160
N'-(4,5-dimethyl-1,3-thiazol-2-yl)hexane-1,6-diamine
CID 107844668
5-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]pentanamide
CID 106238769
2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethyl carbamate
CID 83204866
2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114749702
2-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethylamino]acetaldehyde
CID 174483066
4,5-dimethyl-N-(4-methylsulfanylbutyl)-1,3-thiazol-2-amine
CID 115691855
N-(3-cyclopropylpropyl)-4,5-dimethyl-1,3-thiazol-2-amine
CID 115691858
N-(2-cyclopentylethyl)-4,5-dimethyl-1,3-thiazol-2-amine
CID 65169325
6-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-4,4-dimethylhexanoic acid
CID 65284896
N-(2-cyclohexylethyl)-4,5-dimethyl-1,3-thiazol-2-amine
CID 65169326

Frequently Asked Questions

What is the IUPAC name of 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol?
The IUPAC name of 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol (CID 65169269) is 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol?
The canonical SMILES for 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol is Cc1nc(NCCO)sc1C.
What is the InChIKey of 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol?
The InChIKey is WFDDXLYAFSELPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2OS/c1-5-6(2)11-7(9-5)8-3-4-10/h10H,3-4H2,1-2H3,(H,8,9).
What are the key properties of 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol?
2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol has a molecular weight of 172.25 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol is sourced from PubChem (CID 65169269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).