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

C10H18N2OS — CID 62754186

IUPAC1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol
SMILESCC(C)CN(C)c1ncc(C(C)O)s1
InChIInChI=1S/C10H18N2OS/c1-7(2)6-12(4)10-11-5-9(14-10)8(3)13/h5,7-8,13H,6H2,1-4H3
InChIKeyKTBNBXOVOAIUMR-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.29
Rot. Bonds4

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

1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol (PubChem CID 62754186) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol
PubChem CID62754186
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol
SMILESCC(C)CN(C)c1ncc(C(C)O)s1
InChIInChI=1S/C10H18N2OS/c1-7(2)6-12(4)10-11-5-9(14-10)8(3)13/h5,7-8,13H,6H2,1-4H3
InChIKeyKTBNBXOVOAIUMR-UHFFFAOYSA-N
XLogP2.29
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-methyl-1-(5-propan-2-yl-1,3-thiazol-2-yl)pyrrolidin-3-ol
CID 164636086
2,2,2-Trifluoro-1-(2-morpholinothiazol-5-yl)ethanol
CID 67401740
1-(2-Amino-1,3-thiazol-5-yl)-2,2,2-trifluoroethanol
CID 87904345
3-Amino-2-[2-(diethylamino)-1,3-thiazol-5-yl]-1,1,1-trifluoropropan-2-ol
CID 47003446
(2R)-3-amino-2-[2-(diethylamino)-1,3-thiazol-5-yl]-1,1,1-trifluoropropan-2-ol
CID 51922106
(2S)-3-amino-2-[2-(diethylamino)-1,3-thiazol-5-yl]-1,1,1-trifluoropropan-2-ol
CID 51922108
1-[2-[Propan-2-yl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]ethanol
CID 55112080
1-[2-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanol
CID 55140587
[2-[Propyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62752492
1-[2-[Propyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]ethanol
CID 62752654
[2-[Methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62752989
1-[2-[Methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]ethanol
CID 62753171

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol (CID 62754186) is 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol is CC(C)CN(C)c1ncc(C(C)O)s1.
What is the InChIKey of 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol?
The InChIKey is KTBNBXOVOAIUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-7(2)6-12(4)10-11-5-9(14-10)8(3)13/h5,7-8,13H,6H2,1-4H3.
What are the key properties of 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol?
1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol has a molecular weight of 214.33 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl(2-methylpropyl)amino]-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 62754186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).