N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide

C21H19NO3 — CID 110885288

IUPACN-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide
SMILESCC(O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H19NO3/c1-15(23)19-9-5-6-10-20(19)22-21(24)16-11-13-18(14-12-16)25-17-7-3-2-4-8-17/h2-15,23H,1H3,(H,22,24)
InChIKeyPMFNZRXGSIOJJP-UHFFFAOYSA-N
MW333.39 g/mol
LogP4.78
Rot. Bonds5

About N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide

N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide (PubChem CID 110885288) has the molecular formula C21H19NO3 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide.

Molecular Properties

Compound NameN-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide
PubChem CID110885288
Molecular FormulaC21H19NO3
Molecular Weight333.39 g/mol
Exact Mass333.14
IUPAC NameN-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide
SMILESCC(O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H19NO3/c1-15(23)19-9-5-6-10-20(19)22-21(24)16-11-13-18(14-12-16)25-17-7-3-2-4-8-17/h2-15,23H,1H3,(H,22,24)
InChIKeyPMFNZRXGSIOJJP-UHFFFAOYSA-N
XLogP4.78
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-4-phenoxybenzamide
CID 7915018
N-(2-propan-2-ylphenyl)benzamide
CID 723391
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109043167
4-phenoxy-N-[2-(trifluoromethyl)phenyl]benzamide
CID 16651583
1-N-(4-methoxyphenyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049815
4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
CID 17380470
N-(2-propan-2-ylphenyl)-4-propoxybenzamide
CID 6463952
N-(4-acetamidophenyl)-4-phenoxybenzamide
CID 16651566
2-hydroxy-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508470
N-[2,6-di(propan-2-yl)phenyl]-4-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]oxybenzamide
CID 4101668
N-[2-(1-hydroxyethyl)phenyl]-3-phenoxypropanamide
CID 43508522
N-(2-chloro-3-pyridinyl)-4-phenoxybenzamide
CID 837045

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide?
The IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide (CID 110885288) is N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide.
What is the SMILES notation for N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide?
The canonical SMILES for N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide is CC(O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide?
The InChIKey is PMFNZRXGSIOJJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO3/c1-15(23)19-9-5-6-10-20(19)22-21(24)16-11-13-18(14-12-16)25-17-7-3-2-4-8-17/h2-15,23H,1H3,(H,22,24).
What are the key properties of N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide?
N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide has a molecular weight of 333.39 g/mol, XLogP of 4.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide is sourced from PubChem (CID 110885288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).