N-(2-adamantyl)-4-phenylbenzamide

C23H25NO — CID 3608392

IUPACN-(2-adamantyl)-4-phenylbenzamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H25NO/c25-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)24-22-20-11-15-10-16(13-20)14-21(22)12-15/h1-9,15-16,20-22H,10-14H2,(H,24,25)
InChIKeyPIIJQPFFBZAUTB-UHFFFAOYSA-N
MW331.46 g/mol
LogP4.91
Rot. Bonds3

About N-(2-adamantyl)-4-phenylbenzamide

N-(2-adamantyl)-4-phenylbenzamide (PubChem CID 3608392) has the molecular formula C23H25NO and a molecular weight of 331.46 g/mol. Its IUPAC name is N-(2-adamantyl)-4-phenylbenzamide.

Molecular Properties

Compound NameN-(2-adamantyl)-4-phenylbenzamide
PubChem CID3608392
Molecular FormulaC23H25NO
Molecular Weight331.46 g/mol
Exact Mass331.19
IUPAC NameN-(2-adamantyl)-4-phenylbenzamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H25NO/c25-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)24-22-20-11-15-10-16(13-20)14-21(22)12-15/h1-9,15-16,20-22H,10-14H2,(H,24,25)
InChIKeyPIIJQPFFBZAUTB-UHFFFAOYSA-N
XLogP4.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-adamantyl)-4-phenylbenzamide 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

1-(2-adamantyl)-3-(4-phenylphenyl)urea
CID 3352723
N-(2-adamantyl)-3-benzamido-4-methylbenzamide
CID 78862723
N-(2-adamantyl)-4-formamidobenzamide
CID 168651287
N-(2-adamantyl)-4-(1H-imidazol-5-yl)benzamide
CID 141106162
N-(2-adamantyl)-2-(4-benzamidophenyl)-3H-benzimidazole-5-carboxamide
CID 20740044
N-(2-adamantyl)-4-[4-[4-(2-adamantylcarbamoyl)phenoxy]-2,3,5,6-tetrafluorophenoxy]benzamide
CID 4244949
1-[4-(2-adamantylcarbamoyl)phenyl]piperidine-4-carboxylic acid
CID 23655014
N-(2-adamantyl)-2-aminobenzamide
CID 61214981
N-(2-adamantyl)-3-bromobenzamide
CID 771513
N-(2-adamantyl)thiophene-3-carboxamide
CID 24555583
N-[(2S)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-4-phenylbenzamide
CID 175179674
N-(2,3-dihydro-1H-inden-2-yl)-4-phenylbenzamide
CID 70291620

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-4-phenylbenzamide?
The IUPAC name of N-(2-adamantyl)-4-phenylbenzamide (CID 3608392) is N-(2-adamantyl)-4-phenylbenzamide.
What is the SMILES notation for N-(2-adamantyl)-4-phenylbenzamide?
The canonical SMILES for N-(2-adamantyl)-4-phenylbenzamide is O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-(2-adamantyl)-4-phenylbenzamide?
The InChIKey is PIIJQPFFBZAUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO/c25-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)24-22-20-11-15-10-16(13-20)14-21(22)12-15/h1-9,15-16,20-22H,10-14H2,(H,24,25).
What are the key properties of N-(2-adamantyl)-4-phenylbenzamide?
N-(2-adamantyl)-4-phenylbenzamide has a molecular weight of 331.46 g/mol, XLogP of 4.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-4-phenylbenzamide is sourced from PubChem (CID 3608392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).