[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol

C13H20N2O2S — CID 63916252

IUPAC[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol
SMILESCCC1COCCN1c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C13H20N2O2S/c1-2-10-8-17-6-5-15(10)13-14-12(9-3-4-9)11(7-16)18-13/h9-10,16H,2-8H2,1H3
InChIKeyUZCHEBZBOOHIBM-UHFFFAOYSA-N
MW268.38 g/mol
LogP2.13
Rot. Bonds4

About [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol

[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 63916252) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol
PubChem CID63916252
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC Name[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol
SMILESCCC1COCCN1c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C13H20N2O2S/c1-2-10-8-17-6-5-15(10)13-14-12(9-3-4-9)11(7-16)18-13/h9-10,16H,2-8H2,1H3
InChIKeyUZCHEBZBOOHIBM-UHFFFAOYSA-N
XLogP2.13
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol (CID 63916252) is [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol is CCC1COCCN1c1nc(C2CC2)c(CO)s1.
What is the InChIKey of [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is UZCHEBZBOOHIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c1-2-10-8-17-6-5-15(10)13-14-12(9-3-4-9)11(7-16)18-13/h9-10,16H,2-8H2,1H3.
What are the key properties of [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol?
[4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 268.38 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-(3-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63916252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).