N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide

C19H28N2O3 — CID 46983829

IUPACN-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide
SMILESC=C(C)COc1ccccc1C(=O)N(C)CC(C)N1CCOCC1
InChIInChI=1S/C19H28N2O3/c1-15(2)14-24-18-8-6-5-7-17(18)19(22)20(4)13-16(3)21-9-11-23-12-10-21/h5-8,16H,1,9-14H2,2-4H3
InChIKeyLMELDZHWTFNCOI-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.43
Rot. Bonds7

About N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide

N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide (PubChem CID 46983829) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide.

Molecular Properties

Compound NameN-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide
PubChem CID46983829
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide
SMILESC=C(C)COc1ccccc1C(=O)N(C)CC(C)N1CCOCC1
InChIInChI=1S/C19H28N2O3/c1-15(2)14-24-18-8-6-5-7-17(18)19(22)20(4)13-16(3)21-9-11-23-12-10-21/h5-8,16H,1,9-14H2,2-4H3
InChIKeyLMELDZHWTFNCOI-UHFFFAOYSA-N
XLogP2.43
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(2-acetylphenyl)-N-methyl-N-[(2R)-2-morpholin-4-ylpropyl]benzamide
CID 126428736
4-(2-acetylphenyl)-N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]benzamide
CID 126428735
N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]-2-phenylpyrimidine-5-carboxamide
CID 95551014
2-(2-amino-2-oxoethoxy)-N-methyl-N-(2-methylpropyl)benzamide
CID 134005920
N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-2-(2-methylprop-2-enoxy)benzamide
CID 46987339
N-[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methyl-2-(2-methylprop-2-enoxy)benzamide
CID 46998485
(3,4-diaminophenyl)-[2-(2-morpholin-4-ylpropoxy)phenyl]methanone
CID 154418436
1-methyl-3-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-[(2S)-2-morpholin-4-ylpropyl]urea
CID 126452651
3-[[2-(2-ethoxyethoxy)benzoyl]-methylamino]-2-methylpropanoic acid
CID 119227986
2-methyl-3-[methyl-[2-[(2-methylphenyl)methoxy]benzoyl]amino]propanoic acid
CID 122111976
1,2-bis(2-methylprop-2-enoxy)benzene
CID 10878622
2-ethoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027029

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide?
The IUPAC name of N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide (CID 46983829) is N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide.
What is the SMILES notation for N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide?
The canonical SMILES for N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide is C=C(C)COc1ccccc1C(=O)N(C)CC(C)N1CCOCC1.
What is the InChIKey of N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide?
The InChIKey is LMELDZHWTFNCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-15(2)14-24-18-8-6-5-7-17(18)19(22)20(4)13-16(3)21-9-11-23-12-10-21/h5-8,16H,1,9-14H2,2-4H3.
What are the key properties of N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide?
N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide has a molecular weight of 332.44 g/mol, XLogP of 2.43, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylprop-2-enoxy)-N-(2-morpholin-4-ylpropyl)benzamide is sourced from PubChem (CID 46983829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).