N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide

C23H23NO2 — CID 23344318

IUPACN-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide
SMILESCC(O)Cc1cccc(-c2ccccc2)c1C(=O)NCc1ccccc1
InChIInChI=1S/C23H23NO2/c1-17(25)15-20-13-8-14-21(19-11-6-3-7-12-19)22(20)23(26)24-16-18-9-4-2-5-10-18/h2-14,17,25H,15-16H2,1H3,(H,24,26)
InChIKeyMWJDKKSENIEQGC-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.21
Rot. Bonds6

About N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide

N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide (PubChem CID 23344318) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide.

Molecular Properties

Compound NameN-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide
PubChem CID23344318
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide
SMILESCC(O)Cc1cccc(-c2ccccc2)c1C(=O)NCc1ccccc1
InChIInChI=1S/C23H23NO2/c1-17(25)15-20-13-8-14-21(19-11-6-3-7-12-19)22(20)23(26)24-16-18-9-4-2-5-10-18/h2-14,17,25H,15-16H2,1H3,(H,24,26)
InChIKeyMWJDKKSENIEQGC-UHFFFAOYSA-N
XLogP4.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(benzylcarbamoyl)-3-(3-bromophenyl)phenyl]ethyl methanesulfonate
CID 23344391
N-benzyl-2-methylpropanamide;methane
CID 160760567
N-benzyl-2-[3-(methylcarbamoyl)phenyl]benzamide
CID 171673970
carbonic acid;1-(2-methylpropyl)-2-phenylbenzene
CID 157367920
1-N,2-N,3-N-tribenzylbenzene-1,2,3-tricarboxamide
CID 70015173
2-[(2-methylpyrimidin-5-yl)methylcarbamoyl]-3-phenylbenzoic acid
CID 131743681
N-benzyl-6-(2-hydroxyethyl)-3,4-dimethyl-2-phenylbenzamide
CID 23344325
2-hydroxy-6-[(2S)-2-hydroxypropyl]benzoic acid
CID 162921751
2-methyl-N-[[3-[(2-methylpropanoylamino)methyl]phenyl]methyl]propanamide
CID 4168870
N-benzyl-N'-[(2S)-2-hydroxypropyl]oxamide
CID 6593599
(2S,3S)-3-amino-N-benzyl-2-hydroxybutanamide
CID 71428233
1-benzyl-3-(2-hydroxypropyl)urea
CID 103604143

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide?
The IUPAC name of N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide (CID 23344318) is N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide.
What is the SMILES notation for N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide?
The canonical SMILES for N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide is CC(O)Cc1cccc(-c2ccccc2)c1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide?
The InChIKey is MWJDKKSENIEQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17(25)15-20-13-8-14-21(19-11-6-3-7-12-19)22(20)23(26)24-16-18-9-4-2-5-10-18/h2-14,17,25H,15-16H2,1H3,(H,24,26).
What are the key properties of N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide?
N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide has a molecular weight of 345.44 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-hydroxypropyl)-6-phenylbenzamide is sourced from PubChem (CID 23344318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).