1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol

C11H20N2O2S — CID 64545007

IUPAC1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol
SMILESCCN(c1nc(C(C)O)cs1)C(C)COC
InChIInChI=1S/C11H20N2O2S/c1-5-13(8(2)6-15-4)11-12-10(7-16-11)9(3)14/h7-9,14H,5-6H2,1-4H3
InChIKeyAMFBWLYFAOUGSN-UHFFFAOYSA-N
MW244.36 g/mol
LogP2.06
Rot. Bonds6

About 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol

1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol (PubChem CID 64545007) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol
PubChem CID64545007
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC Name1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol
SMILESCCN(c1nc(C(C)O)cs1)C(C)COC
InChIInChI=1S/C11H20N2O2S/c1-5-13(8(2)6-15-4)11-12-10(7-16-11)9(3)14/h7-9,14H,5-6H2,1-4H3
InChIKeyAMFBWLYFAOUGSN-UHFFFAOYSA-N
XLogP2.06
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol (CID 64545007) is 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol is CCN(c1nc(C(C)O)cs1)C(C)COC.
What is the InChIKey of 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol?
The InChIKey is AMFBWLYFAOUGSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c1-5-13(8(2)6-15-4)11-12-10(7-16-11)9(3)14/h7-9,14H,5-6H2,1-4H3.
What are the key properties of 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol?
1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol has a molecular weight of 244.36 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 64545007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).