N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide

C14H22N2O — CID 79196148

IUPACN-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide
SMILESCCN(C(=O)C(C)CNC)c1ccccc1C
InChIInChI=1S/C14H22N2O/c1-5-16(14(17)12(3)10-15-4)13-9-7-6-8-11(13)2/h6-9,12,15H,5,10H2,1-4H3
InChIKeyUPCQXRAICGYHHY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.20
Rot. Bonds5

About N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide

N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide (PubChem CID 79196148) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide
PubChem CID79196148
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide
SMILESCCN(C(=O)C(C)CNC)c1ccccc1C
InChIInChI=1S/C14H22N2O/c1-5-16(14(17)12(3)10-15-4)13-9-7-6-8-11(13)2/h6-9,12,15H,5,10H2,1-4H3
InChIKeyUPCQXRAICGYHHY-UHFFFAOYSA-N
XLogP2.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methyl-N-(2-methylphenyl)pentanamide
CID 2890658
N-ethyl-2-methyl-3-(methylamino)-N-phenylpropanamide
CID 79196237
N-ethyl-2-methyl-3-(methylamino)-N-phenylpropanamide;hydrochloride
CID 119670324
3-(N-ethyl-2-methylanilino)-2-methyl-3-oxopropanoic acid
CID 114896860
N-[2-(N-ethyl-2-methylanilino)ethyl]-2-methyl-3-(methylamino)propanamide;dihydrochloride
CID 119853428
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
N-ethyl-2,2-difluoro-N-(2-methylphenyl)acetamide
CID 103515266
N-ethyl-2-methyl-3-(methylamino)-N-[(2-methylphenyl)methyl]propanamide;hydrochloride
CID 119722155
N,N'-diethyl-N,N'-bis(2-methylphenyl)-2-phenylpropanediamide
CID 3396233
N-ethyl-2-(N'-hydroxycarbamimidoyl)-3-methyl-N-(2-methylphenyl)butanamide
CID 76925161
N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide
CID 47332754
(2S)-3-(4-bromophenyl)sulfonyl-N-ethyl-2-methyl-N-(2-methylphenyl)propanamide
CID 96537482

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide?
The IUPAC name of N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide (CID 79196148) is N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide.
What is the SMILES notation for N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide?
The canonical SMILES for N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide is CCN(C(=O)C(C)CNC)c1ccccc1C.
What is the InChIKey of N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide?
The InChIKey is UPCQXRAICGYHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-5-16(14(17)12(3)10-15-4)13-9-7-6-8-11(13)2/h6-9,12,15H,5,10H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide?
N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide has a molecular weight of 234.34 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide is sourced from PubChem (CID 79196148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).