4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide

C14H20N2O2 — CID 64997091

IUPAC4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide
SMILESCC(C)C(=O)CNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H20N2O2/c1-10(2)13(17)9-15-14(18)11-5-7-12(8-6-11)16(3)4/h5-8,10H,9H2,1-4H3,(H,15,18)
InChIKeyXQEFYBHSVKXOPQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.71
Rot. Bonds5

About 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide

4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide (PubChem CID 64997091) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide
PubChem CID64997091
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide
SMILESCC(C)C(=O)CNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H20N2O2/c1-10(2)13(17)9-15-14(18)11-5-7-12(8-6-11)16(3)4/h5-8,10H,9H2,1-4H3,(H,15,18)
InChIKeyXQEFYBHSVKXOPQ-UHFFFAOYSA-N
XLogP1.71
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
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4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide
CID 110473275
4-tert-butyl-N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]benzamide
CID 108542009
(2-methylphenyl) 2-[[4-(dimethylamino)benzoyl]amino]acetate
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4-(dimethylamino)-N-[3-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]benzamide;methylsulfanylmethane
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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide (CID 64997091) is 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide is CC(C)C(=O)CNC(=O)c1ccc(N(C)C)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide?
The InChIKey is XQEFYBHSVKXOPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(2)13(17)9-15-14(18)11-5-7-12(8-6-11)16(3)4/h5-8,10H,9H2,1-4H3,(H,15,18).
What are the key properties of 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide?
4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide is sourced from PubChem (CID 64997091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).