2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide

C18H23N3O2S — CID 71991299

IUPAC2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCC(NC(=O)CC1CN(Cc2ccccc2)CCO1)c1nccs1
InChIInChI=1S/C18H23N3O2S/c1-14(18-19-7-10-24-18)20-17(22)11-16-13-21(8-9-23-16)12-15-5-3-2-4-6-15/h2-7,10,14,16H,8-9,11-13H2,1H3,(H,20,22)
InChIKeyCIGSBHIZKVZXKV-UHFFFAOYSA-N
MW345.47 g/mol
LogP2.61
Rot. Bonds6

About 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide

2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 71991299) has the molecular formula C18H23N3O2S and a molecular weight of 345.47 g/mol. Its IUPAC name is 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID71991299
Molecular FormulaC18H23N3O2S
Molecular Weight345.47 g/mol
Exact Mass345.15
IUPAC Name2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCC(NC(=O)CC1CN(Cc2ccccc2)CCO1)c1nccs1
InChIInChI=1S/C18H23N3O2S/c1-14(18-19-7-10-24-18)20-17(22)11-16-13-21(8-9-23-16)12-15-5-3-2-4-6-15/h2-7,10,14,16H,8-9,11-13H2,1H3,(H,20,22)
InChIKeyCIGSBHIZKVZXKV-UHFFFAOYSA-N
XLogP2.61
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.47
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-[[2-[(2S)-4-benzylmorpholin-2-yl]acetyl]amino]-3-methylbutanoic acid
CID 124681649
2-(4-benzylmorpholin-2-yl)-N-(3-hydroxybutyl)acetamide
CID 111539052
N-(3-amino-2-methylpropyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119995447
1-[(3S,4S)-1-benzyl-4-methylpyrrolidin-3-yl]-3-[(1S)-1-(1,3-thiazol-2-yl)ethyl]urea
CID 99855312
2-(4-benzylmorpholin-2-yl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111540025
N-(2-aminoethyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119383303
2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide
CID 71991420
N-(2-amino-1-cyclohexylethyl)-2-(4-benzylmorpholin-2-yl)acetamide;dihydrochloride
CID 119590174
N-[(4-benzylmorpholin-2-yl)methyl]-3-methylbutanamide
CID 134057519
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide
CID 91784573
2-[(2S)-4-benzylmorpholin-2-yl]-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 124588180
2-(4-benzylmorpholin-2-yl)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)acetamide
CID 90651071

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide (CID 71991299) is 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide is CC(NC(=O)CC1CN(Cc2ccccc2)CCO1)c1nccs1.
What is the InChIKey of 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is CIGSBHIZKVZXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2S/c1-14(18-19-7-10-24-18)20-17(22)11-16-13-21(8-9-23-16)12-15-5-3-2-4-6-15/h2-7,10,14,16H,8-9,11-13H2,1H3,(H,20,22).
What are the key properties of 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide?
2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 345.47 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 71991299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).