N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide

C18H27N3O4 — CID 119744249

IUPACN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C18H27N3O4/c1-13-11-21(12-14(2)25-13)18(23)15-4-6-16(7-5-15)20-17(22)10-19-8-9-24-3/h4-7,13-14,19H,8-12H2,1-3H3,(H,20,22)
InChIKeyXGWHYRAPHRSYEF-UHFFFAOYSA-N
MW349.43 g/mol
LogP1.11
Rot. Bonds7

About N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide

N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119744249) has the molecular formula C18H27N3O4 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119744249
Molecular FormulaC18H27N3O4
Molecular Weight349.43 g/mol
Exact Mass349.20
IUPAC NameN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C18H27N3O4/c1-13-11-21(12-14(2)25-13)18(23)15-4-6-16(7-5-15)20-17(22)10-19-8-9-24-3/h4-7,13-14,19H,8-12H2,1-3H3,(H,20,22)
InChIKeyXGWHYRAPHRSYEF-UHFFFAOYSA-N
XLogP1.11
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide
CID 119744229
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide;hydrochloride
CID 119744228
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119744220
ethyl 1-[4-[[2-(2-methoxyethylamino)acetyl]amino]benzoyl]piperidine-4-carboxylate
CID 119797301
methyl 2-[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]anilino]acetate
CID 94631757
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
CID 42915501
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
CID 62170653
(2,6-dimethylmorpholin-4-yl)-[4-(ethylamino)phenyl]methanone
CID 62170652
N-(4-iodophenyl)-2-(2-methoxyethylamino)acetamide
CID 54819702
2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
ethyl 4-[[2-(2-methoxyethylamino)acetyl]amino]benzoate;hydrochloride
CID 119672462

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide (CID 119744249) is N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide is COCCNCC(=O)Nc1ccc(C(=O)N2CC(C)OC(C)C2)cc1.
What is the InChIKey of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is XGWHYRAPHRSYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O4/c1-13-11-21(12-14(2)25-13)18(23)15-4-6-16(7-5-15)20-17(22)10-19-8-9-24-3/h4-7,13-14,19H,8-12H2,1-3H3,(H,20,22).
What are the key properties of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide?
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 349.43 g/mol, XLogP of 1.11, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119744249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).