2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one

C17H26N2O2 — CID 17399590

IUPAC2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
SMILESCc1ccc(NC(C)C(=O)N2CC(C)OC(C)C2)cc1C
InChIInChI=1S/C17H26N2O2/c1-11-6-7-16(8-12(11)2)18-15(5)17(20)19-9-13(3)21-14(4)10-19/h6-8,13-15,18H,9-10H2,1-5H3
InChIKeyLSDMNMWMGVWVGK-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.74
Rot. Bonds3

About 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one

2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one (PubChem CID 17399590) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one.

Molecular Properties

Compound Name2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
PubChem CID17399590
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
SMILESCc1ccc(NC(C)C(=O)N2CC(C)OC(C)C2)cc1C
InChIInChI=1S/C17H26N2O2/c1-11-6-7-16(8-12(11)2)18-15(5)17(20)19-9-13(3)21-14(4)10-19/h6-8,13-15,18H,9-10H2,1-5H3
InChIKeyLSDMNMWMGVWVGK-UHFFFAOYSA-N
XLogP2.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(4-bromo-3-methylanilino)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-1-one
CID 7831927
2-(4-bromoanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 17402101
(2S)-2-(1,3-benzodioxol-5-ylamino)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propan-1-one
CID 25360335
(2S)-2-(1,3-benzodioxol-5-ylamino)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-1-one
CID 25360336
2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 4877660
N-(3,4-dimethylphenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 4570981
(2R)-2-(dibenzofuran-2-ylamino)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-1-one
CID 25347499
2-(4-methoxy-3-methylanilino)-1-(4-methylpiperidin-1-yl)propan-1-one
CID 87033324
2-(2,6-dimethylmorpholin-4-yl)-N-(3,4-dimethylphenyl)acetamide
CID 6465799
2-(4-bromo-3-methylanilino)-1-pyrrolidin-1-ylpropan-1-one
CID 43083553
N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-3,4-dimethylbenzamide
CID 51160837
(2R,6R)-N-(4-bromo-3-methylphenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 51944457

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one?
The IUPAC name of 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one (CID 17399590) is 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one.
What is the SMILES notation for 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one?
The canonical SMILES for 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one is Cc1ccc(NC(C)C(=O)N2CC(C)OC(C)C2)cc1C.
What is the InChIKey of 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one?
The InChIKey is LSDMNMWMGVWVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-11-6-7-16(8-12(11)2)18-15(5)17(20)19-9-13(3)21-14(4)10-19/h6-8,13-15,18H,9-10H2,1-5H3.
What are the key properties of 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one?
2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one has a molecular weight of 290.41 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylanilino)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one is sourced from PubChem (CID 17399590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).