1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol

C10H18N2OS — CID 75457527

IUPAC1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol
SMILESCCc1cnc(N(C)CC(C)(C)O)s1
InChIInChI=1S/C10H18N2OS/c1-5-8-6-11-9(14-8)12(4)7-10(2,3)13/h6,13H,5,7H2,1-4H3
InChIKeyZFYCOWRUPASVIU-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.91
Rot. Bonds4

About 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol

1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol (PubChem CID 75457527) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol
PubChem CID75457527
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol
SMILESCCc1cnc(N(C)CC(C)(C)O)s1
InChIInChI=1S/C10H18N2OS/c1-5-8-6-11-9(14-8)12(4)7-10(2,3)13/h6,13H,5,7H2,1-4H3
InChIKeyZFYCOWRUPASVIU-UHFFFAOYSA-N
XLogP1.91
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 ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol (CID 75457527) is 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol is CCc1cnc(N(C)CC(C)(C)O)s1.
What is the InChIKey of 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol?
The InChIKey is ZFYCOWRUPASVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-5-8-6-11-9(14-8)12(4)7-10(2,3)13/h6,13H,5,7H2,1-4H3.
What are the key properties of 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol?
1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol has a molecular weight of 214.33 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-ethyl-1,3-thiazol-2-yl)-methylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 75457527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).