N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide

C21H19NO2 — CID 18552677

IUPACN-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide
SMILESCC(O)c1cccc(NC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C21H19NO2/c1-15(23)19-8-5-9-20(14-19)22-21(24)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-15,23H,1H3,(H,22,24)
InChIKeyNJRMKDPZKRSLCM-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.66
Rot. Bonds4

About N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide

N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide (PubChem CID 18552677) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide
PubChem CID18552677
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC NameN-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide
SMILESCC(O)c1cccc(NC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C21H19NO2/c1-15(23)19-8-5-9-20(14-19)22-21(24)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-15,23H,1H3,(H,22,24)
InChIKeyNJRMKDPZKRSLCM-UHFFFAOYSA-N
XLogP4.66
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841391
N-[3-[(1S)-1-hydroxyethyl]phenyl]-4-propan-2-yloxybenzamide
CID 100803572
N-[3-(2-methylpropanoylamino)phenyl]-4-phenylbenzamide
CID 1332956
3-[(4-phenylbenzoyl)amino]-N-propan-2-ylbenzamide
CID 17197336
4-ethoxy-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841380
2-benzoyl-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841462
3-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 27209859
3-chloro-N-[3-(1-hydroxyethyl)phenyl]-4-methylbenzamide
CID 91676950
3,5-dibromo-N-[3-(1-hydroxyethyl)phenyl]-4-methylbenzamide
CID 91676952
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
N,N-dimethyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 17231735
N-[3-(1-hydroxyethyl)phenyl]-4-methyl-3-nitrobenzamide
CID 4099768

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide?
The IUPAC name of N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide (CID 18552677) is N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide.
What is the SMILES notation for N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide?
The canonical SMILES for N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide is CC(O)c1cccc(NC(=O)c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide?
The InChIKey is NJRMKDPZKRSLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-15(23)19-8-5-9-20(14-19)22-21(24)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-15,23H,1H3,(H,22,24).
What are the key properties of N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide?
N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide has a molecular weight of 317.39 g/mol, XLogP of 4.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide is sourced from PubChem (CID 18552677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).