4-(dimethylamino)-N-(2-ethylhexyl)benzamide

C17H28N2O — CID 60520434

IUPAC4-(dimethylamino)-N-(2-ethylhexyl)benzamide
SMILESCCCCC(CC)CNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C17H28N2O/c1-5-7-8-14(6-2)13-18-17(20)15-9-11-16(12-10-15)19(3)4/h9-12,14H,5-8,13H2,1-4H3,(H,18,20)
InChIKeyWCFLYDOYFPGQDP-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.70
Rot. Bonds8

About 4-(dimethylamino)-N-(2-ethylhexyl)benzamide

4-(dimethylamino)-N-(2-ethylhexyl)benzamide (PubChem CID 60520434) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-ethylhexyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-ethylhexyl)benzamide
PubChem CID60520434
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name4-(dimethylamino)-N-(2-ethylhexyl)benzamide
SMILESCCCCC(CC)CNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C17H28N2O/c1-5-7-8-14(6-2)13-18-17(20)15-9-11-16(12-10-15)19(3)4/h9-12,14H,5-8,13H2,1-4H3,(H,18,20)
InChIKeyWCFLYDOYFPGQDP-UHFFFAOYSA-N
XLogP3.70
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylhexyl)-4-[ethylsulfonyl(methyl)amino]benzamide
CID 133229169
N-[(2S)-2-ethylhexyl]-4-iodobenzamide
CID 95356323
4-butyl-N-(2-ethylhexyl)benzamide
CID 91723782
4-[(4-chlorophenyl)sulfonyl-methylamino]-N-(2-ethylhexyl)benzamide
CID 133185556
2-[[[4-(dimethylamino)benzoyl]amino]methyl]butanoic acid
CID 65217567
N-[(2S)-2-ethylhexyl]-4-octoxybenzamide
CID 125462791
4-(dimethylamino)-N-pentylbenzamide
CID 21064504
N-(2-ethylhexyl)-1,3-benzodioxole-5-carboxamide
CID 2915932
4-(dimethylamino)-N-heptylbenzamide
CID 86046283
4-ethyloctan-2-yl 4-(dimethylamino)benzoate
CID 91100903
N-(2-ethylhexyl)-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide
CID 133163863
4-bromo-3-chloro-N-(2-ethylhexyl)benzamide
CID 81307789

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-ethylhexyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-ethylhexyl)benzamide (CID 60520434) is 4-(dimethylamino)-N-(2-ethylhexyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-ethylhexyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-ethylhexyl)benzamide is CCCCC(CC)CNC(=O)c1ccc(N(C)C)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-ethylhexyl)benzamide?
The InChIKey is WCFLYDOYFPGQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-7-8-14(6-2)13-18-17(20)15-9-11-16(12-10-15)19(3)4/h9-12,14H,5-8,13H2,1-4H3,(H,18,20).
What are the key properties of 4-(dimethylamino)-N-(2-ethylhexyl)benzamide?
4-(dimethylamino)-N-(2-ethylhexyl)benzamide has a molecular weight of 276.42 g/mol, XLogP of 3.70, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-ethylhexyl)benzamide is sourced from PubChem (CID 60520434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).