4-acetamido-N-(1-adamantyl)benzamide

C19H24N2O2 — CID 7732501

IUPAC4-acetamido-N-(1-adamantyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc1
InChIInChI=1S/C19H24N2O2/c1-12(22)20-17-4-2-16(3-5-17)18(23)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15H,6-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyMLGIEFBSOOXMPX-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.34
Rot. Bonds3

About 4-acetamido-N-(1-adamantyl)benzamide

4-acetamido-N-(1-adamantyl)benzamide (PubChem CID 7732501) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-acetamido-N-(1-adamantyl)benzamide.

Molecular Properties

Compound Name4-acetamido-N-(1-adamantyl)benzamide
PubChem CID7732501
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-acetamido-N-(1-adamantyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc1
InChIInChI=1S/C19H24N2O2/c1-12(22)20-17-4-2-16(3-5-17)18(23)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15H,6-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyMLGIEFBSOOXMPX-UHFFFAOYSA-N
XLogP3.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-acetamido-N-(1-adamantyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-acetamido-N-[[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]benzamide
CID 4534624
5-acetamido-N-(1-adamantyl)-2-chlorobenzamide
CID 50957907
N-(1-adamantyl)-4-chlorobenzamide
CID 2848134
N-(1-adamantyl)-4-sulfanylbenzamide
CID 107019898
(2S)-1-acetyl-N-[4-(1-adamantylcarbamoyl)phenyl]pyrrolidine-2-carboxamide
CID 7335387
2-(4-acetamidophenyl)-N-(1-adamantyl)-3H-benzimidazole-5-carboxamide
CID 11304932
4-(1-adamantylcarbamoylamino)-N-cyclopropylbenzamide
CID 17180551
4-(1-adamantylcarbamoylamino)-N-propylbenzamide
CID 17180776
1-(1-adamantyl)-3-(4-tert-butylphenyl)urea
CID 108884866
4-(1-adamantylcarbamoylamino)benzamide
CID 108896054
N-(1-adamantyl)-4-(aminomethyl)benzamide;hydrochloride
CID 119261555
4-(1-bicyclo[1.1.1]pentanylcarbamoyl)benzoic acid
CID 178070536

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-(1-adamantyl)benzamide?
The IUPAC name of 4-acetamido-N-(1-adamantyl)benzamide (CID 7732501) is 4-acetamido-N-(1-adamantyl)benzamide.
What is the SMILES notation for 4-acetamido-N-(1-adamantyl)benzamide?
The canonical SMILES for 4-acetamido-N-(1-adamantyl)benzamide is CC(=O)Nc1ccc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc1.
What is the InChIKey of 4-acetamido-N-(1-adamantyl)benzamide?
The InChIKey is MLGIEFBSOOXMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-12(22)20-17-4-2-16(3-5-17)18(23)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15H,6-11H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 4-acetamido-N-(1-adamantyl)benzamide?
4-acetamido-N-(1-adamantyl)benzamide has a molecular weight of 312.41 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-(1-adamantyl)benzamide is sourced from PubChem (CID 7732501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).