1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol

C11H20N2O2S — CID 81068705

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

About 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol

1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol (PubChem CID 81068705) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol
PubChem CID81068705
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC Name1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol
SMILESCC(C)OCCN(C)c1nc(C(C)O)cs1
InChIInChI=1S/C11H20N2O2S/c1-8(2)15-6-5-13(4)11-12-10(7-16-11)9(3)14/h7-9,14H,5-6H2,1-4H3
InChIKeyBBCNFCMHAMGUSV-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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Related Compounds

1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol
CID 64544599
4-(chloromethyl)-N-methyl-N-(2-propan-2-yloxyethyl)-1,3-thiazol-2-amine
CID 81062599
1-[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-4-yl]ethanol
CID 64543792
4-[(cyclopropylamino)methyl]-N-methyl-N-(2-propan-2-yloxyethyl)-1,3-thiazol-2-amine
CID 81063717
1-[2-[1-(dimethylamino)propan-2-yl-ethylamino]-1,3-thiazol-4-yl]ethanol
CID 103191902
1-[2-[bis(2-methylpropyl)amino]-1,3-thiazol-4-yl]ethanol
CID 64544603
1-[2-[methyl(1-methylsulfanylpropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol
CID 112666407
1-[2-[ethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-4-yl]ethanol
CID 64545007
1-[2-(N,3,5-trimethylanilino)-1,3-thiazol-4-yl]ethanol
CID 64545008
1-[2-(N,4-dimethylanilino)-1,3-thiazol-4-yl]ethanol
CID 64543596
1-[2-[3-(dimethylamino)propyl-ethylamino]-1,3-thiazol-4-yl]ethanol
CID 102998002
4-(1-aminoethyl)-N-(3-methoxypropyl)-N-methyl-1,3-thiazol-2-amine
CID 64543577

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol (CID 81068705) is 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol is CC(C)OCCN(C)c1nc(C(C)O)cs1.
What is the InChIKey of 1-[2-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol?
The InChIKey is BBCNFCMHAMGUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c1-8(2)15-6-5-13(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-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol?
1-[2-[methyl(2-propan-2-yloxyethyl)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-[methyl(2-propan-2-yloxyethyl)amino]-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 81068705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).