4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide

C20H24N2O2 — CID 29442727

IUPAC4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide
SMILESCCCCc1ccc(CC(=O)Nc2ccc(C(=O)NC)cc2)cc1
InChIInChI=1S/C20H24N2O2/c1-3-4-5-15-6-8-16(9-7-15)14-19(23)22-18-12-10-17(11-13-18)20(24)21-2/h6-13H,3-5,14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyUSGZIHACGBVZTG-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.57
Rot. Bonds7

About 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide

4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide (PubChem CID 29442727) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide.

Molecular Properties

Compound Name4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide
PubChem CID29442727
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide
SMILESCCCCc1ccc(CC(=O)Nc2ccc(C(=O)NC)cc2)cc1
InChIInChI=1S/C20H24N2O2/c1-3-4-5-15-6-8-16(9-7-15)14-19(23)22-18-12-10-17(11-13-18)20(24)21-2/h6-13H,3-5,14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyUSGZIHACGBVZTG-UHFFFAOYSA-N
XLogP3.57
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)-4-pentylbenzamide
CID 142206594
4-[3-(4-butylanilino)-2-cyano-3-oxoprop-1-enyl]-N-methylbenzamide
CID 76860112
N,N'-bis(4-butylphenyl)oxamide
CID 3438016
4-butyl-N-(3,4-dichlorophenyl)benzamide
CID 3618565
4-[[2-(hexadecylamino)acetyl]amino]-N-methylbenzamide
CID 54808915
N-(4-butylphenyl)-2-(2-fluorophenyl)acetamide
CID 100635724
2-(methylamino)-N-(4-pentylphenyl)acetamide
CID 61249144
4-[[2-(dimethylamino)acetyl]amino]-N-methylbenzamide
CID 54843994
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
4-butyl-N-(4-methylphenyl)benzamide;prop-1-ene
CID 142028227
N-(4-butylphenyl)-2-naphthalen-1-ylacetamide
CID 7314094
N-methyl-4-[(4-propylanilino)methyl]benzamide
CID 60980914

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide?
The IUPAC name of 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide (CID 29442727) is 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide.
What is the SMILES notation for 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide?
The canonical SMILES for 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide is CCCCc1ccc(CC(=O)Nc2ccc(C(=O)NC)cc2)cc1.
What is the InChIKey of 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide?
The InChIKey is USGZIHACGBVZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-3-4-5-15-6-8-16(9-7-15)14-19(23)22-18-12-10-17(11-13-18)20(24)21-2/h6-13H,3-5,14H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide?
4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide has a molecular weight of 324.42 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-butylphenyl)acetyl]amino]-N-methylbenzamide is sourced from PubChem (CID 29442727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).