N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide

C20H23N3O3 — CID 54836368

IUPACN-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
SMILESCN(C(=O)CNc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C20H23N3O3/c1-22(18-8-3-2-4-9-18)19(24)15-21-17-7-5-6-16(14-17)20(25)23-10-12-26-13-11-23/h2-9,14,21H,10-13,15H2,1H3
InChIKeyVMARXHSCXKLUQM-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.23
Rot. Bonds5

About N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide

N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide (PubChem CID 54836368) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
PubChem CID54836368
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
SMILESCN(C(=O)CNc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C20H23N3O3/c1-22(18-8-3-2-4-9-18)19(24)15-21-17-7-5-6-16(14-17)20(25)23-10-12-26-13-11-23/h2-9,14,21H,10-13,15H2,1H3
InChIKeyVMARXHSCXKLUQM-UHFFFAOYSA-N
XLogP2.23
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide (CID 54836368) is N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide is CN(C(=O)CNc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1.
What is the InChIKey of N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The InChIKey is VMARXHSCXKLUQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-22(18-8-3-2-4-9-18)19(24)15-21-17-7-5-6-16(14-17)20(25)23-10-12-26-13-11-23/h2-9,14,21H,10-13,15H2,1H3.
What are the key properties of N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide has a molecular weight of 353.42 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-(morpholine-4-carbonyl)anilino]-N-phenylacetamide is sourced from PubChem (CID 54836368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).