N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide

C14H21N3O2 — CID 79196582

IUPACN,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
SMILESCNCC(C)C(=O)Nc1ccccc1C(=O)N(C)C
InChIInChI=1S/C14H21N3O2/c1-10(9-15-2)13(18)16-12-8-6-5-7-11(12)14(19)17(3)4/h5-8,10,15H,9H2,1-4H3,(H,16,18)
InChIKeyVHOZDWNLOKUYLJ-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.18
Rot. Bonds5

About N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide

N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide (PubChem CID 79196582) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
PubChem CID79196582
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
SMILESCNCC(C)C(=O)Nc1ccccc1C(=O)N(C)C
InChIInChI=1S/C14H21N3O2/c1-10(9-15-2)13(18)16-12-8-6-5-7-11(12)14(19)17(3)4/h5-8,10,15H,9H2,1-4H3,(H,16,18)
InChIKeyVHOZDWNLOKUYLJ-UHFFFAOYSA-N
XLogP1.18
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide
CID 79196419
4,5-dimethoxy-N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
CID 119719067
2-amino-N-[2-(dimethylcarbamoyl)phenyl]butanediamide
CID 60847281
2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide;hydrochloride
CID 119674747
2-[2-(aminomethyl)pentanoylamino]-N,N-dimethylbenzamide
CID 65226220
N,N'-bis[2-(dimethylcarbamoyl)phenyl]pentanediamide
CID 4943067
N-[2-(methanesulfonamido)phenyl]-2-methyl-3-(methylamino)propanamide
CID 79195522
2-[(4-amino-3-methylbutanoyl)amino]-N,N-dimethylbenzamide
CID 81075404
methyl 2-methyl-3-[[2-methyl-3-(methylamino)propanoyl]amino]benzoate
CID 79196270
N-[2-[benzyl(methyl)amino]phenyl]-2-methyl-3-(methylamino)propanamide;dihydrochloride
CID 119864866
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119717968
2-[2-(4-chlorophenyl)sulfanylpropanoylamino]-N,N-dimethylbenzamide
CID 86929881

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide?
The IUPAC name of N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide (CID 79196582) is N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide.
What is the SMILES notation for N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide?
The canonical SMILES for N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide is CNCC(C)C(=O)Nc1ccccc1C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide?
The InChIKey is VHOZDWNLOKUYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10(9-15-2)13(18)16-12-8-6-5-7-11(12)14(19)17(3)4/h5-8,10,15H,9H2,1-4H3,(H,16,18).
What are the key properties of N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide?
N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide has a molecular weight of 263.34 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide is sourced from PubChem (CID 79196582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).