2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide

C19H30N2O3 — CID 111596023

IUPAC2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide
SMILESCCN(CC(C)(C)O)C(=O)CC1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C19H30N2O3/c1-4-21(15-19(2,3)23)18(22)12-17-14-20(10-11-24-17)13-16-8-6-5-7-9-16/h5-9,17,23H,4,10-15H2,1-3H3
InChIKeyYDNGQEYWIAIJJH-UHFFFAOYSA-N
MW334.46 g/mol
LogP1.90
Rot. Bonds7

About 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide

2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide (PubChem CID 111596023) has the molecular formula C19H30N2O3 and a molecular weight of 334.46 g/mol. Its IUPAC name is 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide
PubChem CID111596023
Molecular FormulaC19H30N2O3
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC Name2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide
SMILESCCN(CC(C)(C)O)C(=O)CC1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C19H30N2O3/c1-4-21(15-19(2,3)23)18(22)12-17-14-20(10-11-24-17)13-16-8-6-5-7-9-16/h5-9,17,23H,4,10-15H2,1-3H3
InChIKeyYDNGQEYWIAIJJH-UHFFFAOYSA-N
XLogP1.90
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-benzyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)morpholine-2-carboxamide
CID 111596452
N-(1-aminopropan-2-yl)-2-(4-benzylmorpholin-2-yl)-N-methylacetamide
CID 119582704
3-[[2-(4-benzylmorpholin-2-yl)acetyl]-methylamino]propanoic acid
CID 119362755
1-benzyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)piperidine-3-carboxamide
CID 136512107
2-(4-benzylmorpholin-2-yl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 56794454
2-[(2S)-4-benzylmorpholin-2-yl]-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 95633368
2-(4-benzylmorpholin-2-yl)-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]acetamide
CID 91842855
(2R)-2-[[2-[(2S)-4-benzylmorpholin-2-yl]acetyl]amino]-3-methylbutanoic acid
CID 124681649
[(2R)-4-benzylmorpholin-2-yl]methanol;hydrochloride
CID 132648231
2-[4-[(4-methylphenyl)methyl]morpholin-2-yl]acetic acid
CID 66433866
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
4-[[[2-[(2R)-4-benzylmorpholin-2-yl]acetyl]amino]methyl]benzoic acid
CID 124703826

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide?
The IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide (CID 111596023) is 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide.
What is the SMILES notation for 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide?
The canonical SMILES for 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide is CCN(CC(C)(C)O)C(=O)CC1CN(Cc2ccccc2)CCO1.
What is the InChIKey of 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide?
The InChIKey is YDNGQEYWIAIJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3/c1-4-21(15-19(2,3)23)18(22)12-17-14-20(10-11-24-17)13-16-8-6-5-7-9-16/h5-9,17,23H,4,10-15H2,1-3H3.
What are the key properties of 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide?
2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide has a molecular weight of 334.46 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylmorpholin-2-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)acetamide is sourced from PubChem (CID 111596023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).