N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide

C17H18N2O4 — CID 163646977

IUPACN-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide
SMILESCCCOc1ccccc1NC(=O)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C17H18N2O4/c1-2-11-23-15-6-4-3-5-14(15)19-17(22)16(21)18-12-7-9-13(20)10-8-12/h3-10,20H,2,11H2,1H3,(H,18,21)(H,19,22)
InChIKeyIJBIBVXENLAWBK-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.76
Rot. Bonds5

About N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide

N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide (PubChem CID 163646977) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide
PubChem CID163646977
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide
SMILESCCCOc1ccccc1NC(=O)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C17H18N2O4/c1-2-11-23-15-6-4-3-5-14(15)19-17(22)16(21)18-12-7-9-13(20)10-8-12/h3-10,20H,2,11H2,1H3,(H,18,21)(H,19,22)
InChIKeyIJBIBVXENLAWBK-UHFFFAOYSA-N
XLogP2.76
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl N-(2-propoxyphenyl)carbamate
CID 19872099
N'-(2-ethoxyphenyl)-N-(4-iodophenyl)oxamide
CID 108531107
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CID 45001237
(E)-3-methyl-4-oxo-4-(2-propoxyanilino)but-2-enoic acid
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N-(2-ethoxyphenyl)-N'-[(Z)-(2-propoxyphenyl)methylideneamino]oxamide
CID 8988821
N-(4-methylphenyl)-2-[2-oxo-2-(2-propoxyanilino)ethyl]sulfanylacetamide
CID 34345609
2-bromo-2-methyl-N-(2-propoxyphenyl)propanamide
CID 114327800
2-anilino-N-(2-propoxyphenyl)acetamide
CID 51286142
N'-(2-ethoxyphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
CID 108987263
2-methylsulfanyl-N-(2-propoxyphenyl)acetamide
CID 112793569
3-amino-N-(2-propoxyphenyl)propanamide;hydrochloride
CID 119268305
2-amino-2-methyl-N-(2-propoxyphenyl)propanamide
CID 61265402

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide?
The IUPAC name of N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide (CID 163646977) is N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide is CCCOc1ccccc1NC(=O)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide?
The InChIKey is IJBIBVXENLAWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-2-11-23-15-6-4-3-5-14(15)19-17(22)16(21)18-12-7-9-13(20)10-8-12/h3-10,20H,2,11H2,1H3,(H,18,21)(H,19,22).
What are the key properties of N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide?
N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide has a molecular weight of 314.34 g/mol, XLogP of 2.76, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide is sourced from PubChem (CID 163646977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).