1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol

C15H26N2O2S — CID 111434600

IUPAC1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol
SMILESCCOC(C)c1nc(CN2CCCCC2C(C)O)cs1
InChIInChI=1S/C15H26N2O2S/c1-4-19-12(3)15-16-13(10-20-15)9-17-8-6-5-7-14(17)11(2)18/h10-12,14,18H,4-9H2,1-3H3
InChIKeyNCDXBIOKPCYMRN-UHFFFAOYSA-N
MW298.45 g/mol
LogP2.98
Rot. Bonds6

About 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol

1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol (PubChem CID 111434600) has the molecular formula C15H26N2O2S and a molecular weight of 298.45 g/mol. Its IUPAC name is 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol
PubChem CID111434600
Molecular FormulaC15H26N2O2S
Molecular Weight298.45 g/mol
Exact Mass298.17
IUPAC Name1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol
SMILESCCOC(C)c1nc(CN2CCCCC2C(C)O)cs1
InChIInChI=1S/C15H26N2O2S/c1-4-19-12(3)15-16-13(10-20-15)9-17-8-6-5-7-14(17)11(2)18/h10-12,14,18H,4-9H2,1-3H3
InChIKeyNCDXBIOKPCYMRN-UHFFFAOYSA-N
XLogP2.98
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.45
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol
CID 111333364
4-[[(2R)-2-(3,4-dimethylphenyl)pyrrolidin-1-yl]methyl]-2-[(1S)-1-ethoxyethyl]-1,3-thiazole
CID 99809569
(3R)-1-[[2-[(1R)-1-ethoxyethyl]-1,3-thiazol-4-yl]methyl]-N-ethylpiperidine-3-carboxamide
CID 95632261
1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
CID 83055721
3-[(2R)-1-[2-[2-[(1R)-1-ethoxyethyl]-1,3-thiazol-4-yl]acetyl]piperidin-2-yl]propanoic acid
CID 124683577
2-(1-ethoxyethyl)-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-1,3-thiazole
CID 122157188
1-[1-[(4-propyl-1,3-thiazol-2-yl)methyl]piperidin-2-yl]ethanamine
CID 120897022
2-[(1S)-1-ethoxyethyl]-4-[[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]-1,3-thiazole
CID 95773430
1-[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]azepan-2-yl]propan-2-ol
CID 114338946
methyl 2-[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]acetate
CID 78992497
1-[4-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-2-(methylamino)ethanone;hydrochloride
CID 120704760
1-[4-[[2-[(1R)-1-ethoxyethyl]-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-3-methylbut-2-en-1-one
CID 96566929

Frequently Asked Questions

What is the IUPAC name of 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol?
The IUPAC name of 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol (CID 111434600) is 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol is CCOC(C)c1nc(CN2CCCCC2C(C)O)cs1.
What is the InChIKey of 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol?
The InChIKey is NCDXBIOKPCYMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S/c1-4-19-12(3)15-16-13(10-20-15)9-17-8-6-5-7-14(17)11(2)18/h10-12,14,18H,4-9H2,1-3H3.
What are the key properties of 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol?
1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol has a molecular weight of 298.45 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 111434600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).