N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide

C19H22N2O3 — CID 108986808

IUPACN'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)c(C)c1
InChIInChI=1S/C19H22N2O3/c1-12(2)24-16-8-6-15(7-9-16)20-18(22)19(23)21-17-10-5-13(3)11-14(17)4/h5-12H,1-4H3,(H,20,22)(H,21,23)
InChIKeyQVLZBFFUWAQBLQ-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.67
Rot. Bonds4

About N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide

N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide (PubChem CID 108986808) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
PubChem CID108986808
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)c(C)c1
InChIInChI=1S/C19H22N2O3/c1-12(2)24-16-8-6-15(7-9-16)20-18(22)19(23)21-17-10-5-13(3)11-14(17)4/h5-12H,1-4H3,(H,20,22)(H,21,23)
InChIKeyQVLZBFFUWAQBLQ-UHFFFAOYSA-N
XLogP3.67
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)ethane-1,2-diamine
CID 54805668
N-(4-cyanophenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108515416
2-oxo-2-(4-propan-2-yloxyanilino)acetic acid
CID 28710622
(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 40771491
N-(3-bromo-4-methylphenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108986806
2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide
CID 62510532
N-(4-chloro-2-methylphenyl)-2,2-dimethyl-N'-(4-propan-2-yloxyphenyl)propanediamide
CID 108969119
(2S)-2-amino-N-(2-methyl-4-propan-2-yloxyphenyl)propanamide
CID 92930680
ethyl 2-oxo-2-(4-propan-2-yloxyanilino)acetate
CID 28710232
N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
CID 44995959
N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108987392

Frequently Asked Questions

What is the IUPAC name of N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide?
The IUPAC name of N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide (CID 108986808) is N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide.
What is the SMILES notation for N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide?
The canonical SMILES for N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)c(C)c1.
What is the InChIKey of N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide?
The InChIKey is QVLZBFFUWAQBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-12(2)24-16-8-6-15(7-9-16)20-18(22)19(23)21-17-10-5-13(3)11-14(17)4/h5-12H,1-4H3,(H,20,22)(H,21,23).
What are the key properties of N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide?
N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide has a molecular weight of 326.40 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4-dimethylphenyl)-N-(4-propan-2-yloxyphenyl)oxamide is sourced from PubChem (CID 108986808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).