N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide

C24H25NO2 — CID 122194663

IUPACN-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide
SMILESCN(Cc1ccccc1)C(=O)CC(CO)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H25NO2/c1-25(17-19-8-4-2-5-9-19)24(27)16-23(18-26)22-14-12-21(13-15-22)20-10-6-3-7-11-20/h2-15,23,26H,16-18H2,1H3
InChIKeyXMGILOLXKQTVQQ-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.48
Rot. Bonds7

About N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide

N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide (PubChem CID 122194663) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide.

Molecular Properties

Compound NameN-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide
PubChem CID122194663
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide
SMILESCN(Cc1ccccc1)C(=O)CC(CO)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H25NO2/c1-25(17-19-8-4-2-5-9-19)24(27)16-23(18-26)22-14-12-21(13-15-22)20-10-6-3-7-11-20/h2-15,23,26H,16-18H2,1H3
InChIKeyXMGILOLXKQTVQQ-UHFFFAOYSA-N
XLogP4.48
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-phenyl]-acetic acid
CID 11122765
trans-(1S,2S)-N-[(1R)-2-hydroxy-1-phenylethyl]-2-phenylcyclohexane-1-carboxamide
CID 145991916
2-[3-(hydroxymethyl)-4-phenylphenyl]-N-methyl-N-(2-phenylethyl)acetamide
CID 10832322
(3S,5R,6R)-1,3,6-Tribenzyl-5-hydroxy-piperidin-2-one
CID 468424
n-Benzyl-n-benzyloxy-2-(4-isopropylphenyl)propanamide
CID 44297789
N-benzyl-N-methyl-2-(4-phenylphenyl)acetamide
CID 90681430
trans-N-benzyl-N-(2-cyclohex-1-en-1-ylethyl)-3-hydroxycyclohexanecarboxamide
CID 91763680
Piperidin-4-ol, 1-acetyl-2,3,6-triphenyl-
CID 577643
2-(Dibenzylcarbamoyl)cyclohexanecarboxylic acid
CID 307337
trans-N-(biphenyl-4-ylmethyl)-3-hydroxycyclohexanecarboxamide
CID 91764753
4-Benzyl-5-hydroxy-1-methyl-4-phenylpyrrolidin-2-one
CID 12394601
5-Hydroxy-1-methyl-4,4-diphenylpyrrolidin-2-one
CID 12394604

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide?
The IUPAC name of N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide (CID 122194663) is N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide.
What is the SMILES notation for N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide?
The canonical SMILES for N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide is CN(Cc1ccccc1)C(=O)CC(CO)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide?
The InChIKey is XMGILOLXKQTVQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-25(17-19-8-4-2-5-9-19)24(27)16-23(18-26)22-14-12-21(13-15-22)20-10-6-3-7-11-20/h2-15,23,26H,16-18H2,1H3.
What are the key properties of N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide?
N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide has a molecular weight of 359.47 g/mol, XLogP of 4.48, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-hydroxy-N-methyl-3-(4-phenylphenyl)butanamide is sourced from PubChem (CID 122194663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).