N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide

C20H16N2O4 — CID 108509256

IUPACN-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
SMILESCC(=O)c1cccc(NC(=O)C(=O)Nc2cccc3c(O)cccc23)c1
InChIInChI=1S/C20H16N2O4/c1-12(23)13-5-2-6-14(11-13)21-19(25)20(26)22-17-9-3-8-16-15(17)7-4-10-18(16)24/h2-11,24H,1H3,(H,21,25)(H,22,26)
InChIKeyPTTGCJQIXQKLEG-UHFFFAOYSA-N
MW348.36 g/mol
LogP3.33
Rot. Bonds3

About N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide

N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide (PubChem CID 108509256) has the molecular formula C20H16N2O4 and a molecular weight of 348.36 g/mol. Its IUPAC name is N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
PubChem CID108509256
Molecular FormulaC20H16N2O4
Molecular Weight348.36 g/mol
Exact Mass348.11
IUPAC NameN-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
SMILESCC(=O)c1cccc(NC(=O)C(=O)Nc2cccc3c(O)cccc23)c1
InChIInChI=1S/C20H16N2O4/c1-12(23)13-5-2-6-14(11-13)21-19(25)20(26)22-17-9-3-8-16-15(17)7-4-10-18(16)24/h2-11,24H,1H3,(H,21,25)(H,22,26)
InChIKeyPTTGCJQIXQKLEG-UHFFFAOYSA-N
XLogP3.33
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-anilinophenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
CID 108509324
N'-(3-acetylphenyl)-N-(2,3-dichlorophenyl)oxamide
CID 108500714
N'-(3-acetylphenyl)-N-[4-(diethylamino)phenyl]oxamide
CID 108515024
N'-(5-hydroxynaphthalen-1-yl)-N-[4-(trifluoromethyl)phenyl]oxamide
CID 108509442
methyl 3-[[2-(4-acetylanilino)-2-oxoacetyl]amino]benzoate
CID 108987464
N'-(3-acetylphenyl)-N-(2-bromo-4-methylphenyl)oxamide
CID 108515070
N-(3-acetylphenyl)-N'-(2,6-dichlorophenyl)oxamide
CID 108515059
N'-(3-acetylphenyl)-N-(4-amino-3-chlorophenyl)oxamide
CID 108514915
3-[[(Z)-2-cyano-3-[(5-hydroxynaphthalen-1-yl)amino]-3-oxoprop-1-enyl]amino]benzoic acid
CID 108842806
N'-(3-acetylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
CID 108987363
N-(3-acetylphenyl)-2-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanylacetamide
CID 9422642
N'-(3-acetylphenyl)-N-(2-hydroxypropyl)oxamide
CID 47225795

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide?
The IUPAC name of N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide (CID 108509256) is N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide.
What is the SMILES notation for N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide?
The canonical SMILES for N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide is CC(=O)c1cccc(NC(=O)C(=O)Nc2cccc3c(O)cccc23)c1.
What is the InChIKey of N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide?
The InChIKey is PTTGCJQIXQKLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O4/c1-12(23)13-5-2-6-14(11-13)21-19(25)20(26)22-17-9-3-8-16-15(17)7-4-10-18(16)24/h2-11,24H,1H3,(H,21,25)(H,22,26).
What are the key properties of N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide?
N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide has a molecular weight of 348.36 g/mol, XLogP of 3.33, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide is sourced from PubChem (CID 108509256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).