N-benzyl-N'-(4-hydroxyphenyl)oxamide

C15H14N2O3 — CID 3022152

IUPACN-benzyl-N'-(4-hydroxyphenyl)oxamide
SMILESO=C(NCc1ccccc1)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C15H14N2O3/c18-13-8-6-12(7-9-13)17-15(20)14(19)16-10-11-4-2-1-3-5-11/h1-9,18H,10H2,(H,16,19)(H,17,20)
InChIKeyMRWVYEMNSLFFKI-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.65
Rot. Bonds3

About N-benzyl-N'-(4-hydroxyphenyl)oxamide

N-benzyl-N'-(4-hydroxyphenyl)oxamide (PubChem CID 3022152) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-benzyl-N'-(4-hydroxyphenyl)oxamide.

Molecular Properties

Compound NameN-benzyl-N'-(4-hydroxyphenyl)oxamide
PubChem CID3022152
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-benzyl-N'-(4-hydroxyphenyl)oxamide
SMILESO=C(NCc1ccccc1)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C15H14N2O3/c18-13-8-6-12(7-9-13)17-15(20)14(19)16-10-11-4-2-1-3-5-11/h1-9,18H,10H2,(H,16,19)(H,17,20)
InChIKeyMRWVYEMNSLFFKI-UHFFFAOYSA-N
XLogP1.65
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

4-(Benzylamino)phenol
CID 7637
4-Acetamido-2-methylphenol
CID 85384
4-Acetamido-2-diethylaminomethylphenol
CID 224175
N-(4-Hydroxy-2-methylphenyl)acetamide
CID 170214
4-[(2-hydroxybenzyl)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
CID 3595244
N-(4-Hydroxyphenyl)cinnamamide
CID 639942
Phenol, 4-[(phenylmethyl)amino]-, hydrochloride (1:1)
CID 16738613
N-(4-hydroxyphenyl)-3-phenylpropanamide
CID 836055
2-(Anilinomethyl)phenol
CID 220804
Tyr-D-Ala-Gly-NMePhe
CID 45483974
N-benzyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamide
CID 863795
(2Z)-2-(acetylamino)-N-(4-hydroxyphenyl)-3-phenylprop-2-enamide
CID 5403184

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N'-(4-hydroxyphenyl)oxamide?
The IUPAC name of N-benzyl-N'-(4-hydroxyphenyl)oxamide (CID 3022152) is N-benzyl-N'-(4-hydroxyphenyl)oxamide.
What is the SMILES notation for N-benzyl-N'-(4-hydroxyphenyl)oxamide?
The canonical SMILES for N-benzyl-N'-(4-hydroxyphenyl)oxamide is O=C(NCc1ccccc1)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-benzyl-N'-(4-hydroxyphenyl)oxamide?
The InChIKey is MRWVYEMNSLFFKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c18-13-8-6-12(7-9-13)17-15(20)14(19)16-10-11-4-2-1-3-5-11/h1-9,18H,10H2,(H,16,19)(H,17,20).
What are the key properties of N-benzyl-N'-(4-hydroxyphenyl)oxamide?
N-benzyl-N'-(4-hydroxyphenyl)oxamide has a molecular weight of 270.29 g/mol, XLogP of 1.65, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N'-(4-hydroxyphenyl)oxamide is sourced from PubChem (CID 3022152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).