2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide

C17H24N2O3 — CID 110352930

IUPAC2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide
SMILESCC1CN(C(=O)c2cccc(NC(=O)C(C)(C)C)c2)CCO1
InChIInChI=1S/C17H24N2O3/c1-12-11-19(8-9-22-12)15(20)13-6-5-7-14(10-13)18-16(21)17(2,3)4/h5-7,10,12H,8-9,11H2,1-4H3,(H,18,21)
InChIKeyGRNJYQUPXBMGRI-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.53
Rot. Bonds2

About 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide

2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide (PubChem CID 110352930) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide
PubChem CID110352930
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide
SMILESCC1CN(C(=O)c2cccc(NC(=O)C(C)(C)C)c2)CCO1
InChIInChI=1S/C17H24N2O3/c1-12-11-19(8-9-22-12)15(20)13-6-5-7-14(10-13)18-16(21)17(2,3)4/h5-7,10,12H,8-9,11H2,1-4H3,(H,18,21)
InChIKeyGRNJYQUPXBMGRI-UHFFFAOYSA-N
XLogP2.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide
CID 110352926
3-methyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]-3-phenylbutanamide
CID 110426827
4-fluoro-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]benzamide
CID 46430432
N-[3-(2-methylmorpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
CID 110352983
1-benzyl-3-[3-(2-methylmorpholine-4-carbonyl)phenyl]urea
CID 110605020
N-[3-(2-methylmorpholine-4-carbonyl)phenyl]-2-(2-methylphenyl)acetamide
CID 110671876
N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]-2,2-dimethylpropanamide
CID 110884052
2-cyclopropyl-2-(4-fluorophenyl)-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]acetamide
CID 110614506
3-(2-methyl-1,4-oxazepane-4-carbonyl)benzoic acid
CID 62967125
N-[3-(2-methylmorpholine-4-carbonyl)phenyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110614500
N-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]-2,2-dimethylpropanamide
CID 34471106
(3-methoxyphenyl)-[(2S)-2-methylmorpholin-4-yl]methanone
CID 51710348

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide (CID 110352930) is 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide is CC1CN(C(=O)c2cccc(NC(=O)C(C)(C)C)c2)CCO1.
What is the InChIKey of 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide?
The InChIKey is GRNJYQUPXBMGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-12-11-19(8-9-22-12)15(20)13-6-5-7-14(10-13)18-16(21)17(2,3)4/h5-7,10,12H,8-9,11H2,1-4H3,(H,18,21).
What are the key properties of 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide?
2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide has a molecular weight of 304.39 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]propanamide is sourced from PubChem (CID 110352930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).