N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide

C17H29N3O2S — CID 74246171

IUPACN-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESCC1(C)CC(CC(=O)N(CCO)Cc2nccs2)CC(C)(C)N1
InChIInChI=1S/C17H29N3O2S/c1-16(2)10-13(11-17(3,4)19-16)9-15(22)20(6-7-21)12-14-18-5-8-23-14/h5,8,13,19,21H,6-7,9-12H2,1-4H3
InChIKeySGFHXQZQJJGGHH-UHFFFAOYSA-N
MW339.51 g/mol
LogP2.41
Rot. Bonds6

About N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide

N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide (PubChem CID 74246171) has the molecular formula C17H29N3O2S and a molecular weight of 339.51 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide
PubChem CID74246171
Molecular FormulaC17H29N3O2S
Molecular Weight339.51 g/mol
Exact Mass339.20
IUPAC NameN-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESCC1(C)CC(CC(=O)N(CCO)Cc2nccs2)CC(C)(C)N1
InChIInChI=1S/C17H29N3O2S/c1-16(2)10-13(11-17(3,4)19-16)9-15(22)20(6-7-21)12-14-18-5-8-23-14/h5,8,13,19,21H,6-7,9-12H2,1-4H3
InChIKeySGFHXQZQJJGGHH-UHFFFAOYSA-N
XLogP2.41
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.51
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(5S,10S)-10-ethyl-1-(2-methoxyethyl)-9-(1,3-thiazol-2-ylmethyl)-1,9-diazaspiro[4.5]decan-2-one
CID 97375574
Sdccgsbi-0117438.P001
CID 26412149
(5R,10S)-10-ethyl-1-(2-methoxyethyl)-9-(1,3-thiazol-2-ylmethyl)-1,9-diazaspiro[4.5]decan-2-one
CID 125251000
(5S,10R)-10-ethyl-9-(1,3-thiazol-2-ylmethyl)-1,9-diazaspiro[4.5]decan-2-one
CID 125252605
2-[1-(2-hydroxy-3,3-dimethylbutyl)piperidin-4-yl]-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 57993397
2-[1-(2-hydroxybutyl)piperidin-4-yl]-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 146617114
N-(2-morpholin-4-ium-4-ylethyl)-N-(1,3-thiazol-2-ylmethyl)cycloheptanecarboxamide
CID 8049504
N-(2-morpholin-4-ylethyl)-N-(1,3-thiazol-2-ylmethyl)cycloheptanecarboxamide
CID 8049505
N-[[1-(cyclohexanecarbonyl)piperidin-3-yl]-(1,3-thiazol-2-yl)methyl]acetamide
CID 46955417
3-piperidin-4-yl-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 55047879
N-(2-hydroxyethyl)-2-methyl-N-(1,3-thiazol-2-ylmethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 56895611
3-piperidin-3-yl-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 61707980

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide (CID 74246171) is N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide is CC1(C)CC(CC(=O)N(CCO)Cc2nccs2)CC(C)(C)N1.
What is the InChIKey of N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The InChIKey is SGFHXQZQJJGGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O2S/c1-16(2)10-13(11-17(3,4)19-16)9-15(22)20(6-7-21)12-14-18-5-8-23-14/h5,8,13,19,21H,6-7,9-12H2,1-4H3.
What are the key properties of N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide has a molecular weight of 339.51 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide is sourced from PubChem (CID 74246171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).