N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide

C18H14N2O4 — CID 108509252

IUPACN'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide
SMILESO=C(Nc1ccccc1O)C(=O)Nc1cccc2c(O)cccc12
InChIInChI=1S/C18H14N2O4/c21-15-10-4-5-11-12(15)6-3-8-13(11)19-17(23)18(24)20-14-7-1-2-9-16(14)22/h1-10,21-22H,(H,19,23)(H,20,24)
InChIKeyAYBILIIFCRLHAZ-UHFFFAOYSA-N
MW322.32 g/mol
LogP2.83
Rot. Bonds2

About N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide

N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide (PubChem CID 108509252) has the molecular formula C18H14N2O4 and a molecular weight of 322.32 g/mol. Its IUPAC name is N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide
PubChem CID108509252
Molecular FormulaC18H14N2O4
Molecular Weight322.32 g/mol
Exact Mass322.10
IUPAC NameN'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide
SMILESO=C(Nc1ccccc1O)C(=O)Nc1cccc2c(O)cccc12
InChIInChI=1S/C18H14N2O4/c21-15-10-4-5-11-12(15)6-3-8-13(11)19-17(23)18(24)20-14-7-1-2-9-16(14)22/h1-10,21-22H,(H,19,23)(H,20,24)
InChIKeyAYBILIIFCRLHAZ-UHFFFAOYSA-N
XLogP2.83
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.32
LogP ≤ 52.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}, {'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-(2-butan-2-ylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
CID 108509432
N'-(5-hydroxynaphthalen-1-yl)-N-[4-(trifluoromethyl)phenyl]oxamide
CID 108509442
N-(3-acetylphenyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
CID 108509256
N'-(2-fluorophenyl)-N-(2-hydroxyphenyl)oxamide
CID 108514248
3-[(5-hydroxynaphthalen-1-yl)amino]-3-oxopropanoic acid
CID 62231947
N-(5-hydroxynaphthalen-1-yl)propanamide
CID 12882754
N-(5-hydroxynaphthalen-1-yl)prop-2-enamide
CID 43700254
N-(5-hydroxynaphthalen-1-yl)-2,2-dimethylpropanamide
CID 64590909
N-(furan-2-ylmethyl)-N'-(5-hydroxynaphthalen-1-yl)oxamide
CID 45492489
N'-benzyl-N-(5-hydroxynaphthalen-1-yl)-N'-methyloxamide
CID 108509276
CID 59553073
CID 59553073

Frequently Asked Questions

What is the IUPAC name of N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide?
The IUPAC name of N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide (CID 108509252) is N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide.
What is the SMILES notation for N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide?
The canonical SMILES for N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide is O=C(Nc1ccccc1O)C(=O)Nc1cccc2c(O)cccc12.
What is the InChIKey of N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide?
The InChIKey is AYBILIIFCRLHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O4/c21-15-10-4-5-11-12(15)6-3-8-13(11)19-17(23)18(24)20-14-7-1-2-9-16(14)22/h1-10,21-22H,(H,19,23)(H,20,24).
What are the key properties of N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide?
N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide has a molecular weight of 322.32 g/mol, XLogP of 2.83, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-hydroxynaphthalen-1-yl)-N-(2-hydroxyphenyl)oxamide is sourced from PubChem (CID 108509252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).