N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide

C15H24N2O — CID 63213774

IUPACN,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide
SMILESCNc1ccc(C(=O)N(C)CCC(C)C)cc1C
InChIInChI=1S/C15H24N2O/c1-11(2)8-9-17(5)15(18)13-6-7-14(16-4)12(3)10-13/h6-7,10-11,16H,8-9H2,1-5H3
InChIKeyRMQBWZWEGLXWIN-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.15
Rot. Bonds5

About N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide

N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide (PubChem CID 63213774) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide.

Molecular Properties

Compound NameN,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide
PubChem CID63213774
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide
SMILESCNc1ccc(C(=O)N(C)CCC(C)C)cc1C
InChIInChI=1S/C15H24N2O/c1-11(2)8-9-17(5)15(18)13-6-7-14(16-4)12(3)10-13/h6-7,10-11,16H,8-9H2,1-5H3
InChIKeyRMQBWZWEGLXWIN-UHFFFAOYSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,3-dimethyl-4-(methylamino)-N-(2-methylpropyl)benzamide
CID 63210523
N-(2-hydroxypropyl)-N,3-dimethyl-4-(methylamino)benzamide
CID 55162088
N-cyclopropyl-3-methyl-4-(methylamino)-N-(3-methylbutyl)benzamide
CID 78925719
3-methyl-4-[[methyl(3-methylbutyl)carbamoyl]amino]benzoic acid
CID 61429218
N-(3-amino-4-methylpentyl)-N,3-dimethyl-4-(3-methylbutanoylamino)benzamide;hydrochloride
CID 119660831
N-[(4-chlorophenyl)methyl]-N,3-dimethyl-4-(methylamino)benzamide
CID 63213909
3-[methyl-[3-methyl-4-(3-methylbutanoylamino)benzoyl]amino]propanoic acid
CID 119232948
N-methyl-2-(methylamino)-N-(3-methylbutyl)benzamide
CID 61377480
N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethyl-4-(methylamino)benzamide
CID 105420406
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-methyl-4-(methylamino)benzamide
CID 107486050
N-(2-cyanopropyl)-N-ethyl-3-methyl-4-(methylamino)benzamide
CID 63213768
4-carbamothioyl-N-methyl-N-(3-methylbutyl)benzamide
CID 61429258

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide?
The IUPAC name of N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide (CID 63213774) is N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide.
What is the SMILES notation for N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide?
The canonical SMILES for N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide is CNc1ccc(C(=O)N(C)CCC(C)C)cc1C.
What is the InChIKey of N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide?
The InChIKey is RMQBWZWEGLXWIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)8-9-17(5)15(18)13-6-7-14(16-4)12(3)10-13/h6-7,10-11,16H,8-9H2,1-5H3.
What are the key properties of N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide?
N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide has a molecular weight of 248.37 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-(methylamino)-N-(3-methylbutyl)benzamide is sourced from PubChem (CID 63213774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).