N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide

C19H30N2O4 — CID 92989560

IUPACN-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCN(C[C@@H]1CN(C(C)(C)CO)CCO1)C(=O)c1ccccc1
InChIInChI=1S/C19H30N2O4/c1-19(2,15-22)21-10-12-25-17(14-21)13-20(9-11-24-3)18(23)16-7-5-4-6-8-16/h4-8,17,22H,9-15H2,1-3H3/t17-/m1/s1
InChIKeyMLXSRTBPTCTQHV-QGZVFWFLSA-N
MW350.46 g/mol
LogP1.25
Rot. Bonds8

About N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide

N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide (PubChem CID 92989560) has the molecular formula C19H30N2O4 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound NameN-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
PubChem CID92989560
Molecular FormulaC19H30N2O4
Molecular Weight350.46 g/mol
Exact Mass350.22
IUPAC NameN-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCN(C[C@@H]1CN(C(C)(C)CO)CCO1)C(=O)c1ccccc1
InChIInChI=1S/C19H30N2O4/c1-19(2,15-22)21-10-12-25-17(14-21)13-20(9-11-24-3)18(23)16-7-5-4-6-8-16/h4-8,17,22H,9-15H2,1-3H3/t17-/m1/s1
InChIKeyMLXSRTBPTCTQHV-QGZVFWFLSA-N
XLogP1.25
TPSA62.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
CID 46041170
N-[[(2S)-4-[(2S)-2-hydroxy-3-methoxypropyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92984293
N-[[4-[2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 46041392
N-[[(2S)-4-[(2S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92984292
N-[[(2S)-4-[(2R)-2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92984291
N-(2-methoxyethyl)-4-methyl-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
CID 46059667
N-[[(2S)-4-[(2S)-2-hydroxy-3-propan-2-yloxypropyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92984280
N-[2-(dimethylamino)ethyl]-N-[[4-(2-methoxyacetyl)morpholin-2-yl]methyl]benzamide
CID 42861666
N-[[(2S)-4-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 99731560
N-[[(2S)-4-[(2S)-3-(4-fluorophenoxy)-2-hydroxypropyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92989538
N-[[4-(2-methoxybenzoyl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)-4-methylbenzamide
CID 42861605
N-[[(2S)-4-[(2R)-2-hydroxybutyl]morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide
CID 92989417

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide?
The IUPAC name of N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide (CID 92989560) is N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide?
The canonical SMILES for N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide is COCCN(C[C@@H]1CN(C(C)(C)CO)CCO1)C(=O)c1ccccc1.
What is the InChIKey of N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide?
The InChIKey is MLXSRTBPTCTQHV-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H30N2O4/c1-19(2,15-22)21-10-12-25-17(14-21)13-20(9-11-24-3)18(23)16-7-5-4-6-8-16/h4-8,17,22H,9-15H2,1-3H3/t17-/m1/s1.
What are the key properties of N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide?
N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 1.25, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 92989560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).