N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide

C18H19N3O3 — CID 108512277

IUPACN-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2ccccc2C(N)=O)c(C)c1
InChIInChI=1S/C18H19N3O3/c1-10-8-11(2)15(12(3)9-10)21-18(24)17(23)20-14-7-5-4-6-13(14)16(19)22/h4-9H,1-3H3,(H2,19,22)(H,20,23)(H,21,24)
InChIKeyYCKBTWMMRMQMDE-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.29
Rot. Bonds3

About N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide

N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide (PubChem CID 108512277) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
PubChem CID108512277
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2ccccc2C(N)=O)c(C)c1
InChIInChI=1S/C18H19N3O3/c1-10-8-11(2)15(12(3)9-10)21-18(24)17(23)20-14-7-5-4-6-13(14)16(19)22/h4-9H,1-3H3,(H2,19,22)(H,20,23)(H,21,24)
InChIKeyYCKBTWMMRMQMDE-UHFFFAOYSA-N
XLogP2.29
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512305
N,N'-bis(2,4,6-trimethylphenyl)oxamide
CID 13271247
2-hydrazinyl-N-(2,4,6-trimethylphenyl)benzamide
CID 62235197
N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512317
N-(2-cyanophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108501524
N-(4-hydroxy-2-methylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108509461
N-(2-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 108529456
N-(2-carbamoylphenyl)-N'-propan-2-yloxamide
CID 108503318
N'-(2-carbamoylphenyl)-N-(2-ethylphenyl)oxamide
CID 108529346
N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 48528626
N'-(2-carbamoylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide
CID 108529438
N-(2-carbamoylphenyl)-N'-(2,5-difluorophenyl)oxamide
CID 108529490

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The IUPAC name of N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide (CID 108512277) is N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide is Cc1cc(C)c(NC(=O)C(=O)Nc2ccccc2C(N)=O)c(C)c1.
What is the InChIKey of N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The InChIKey is YCKBTWMMRMQMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-10-8-11(2)15(12(3)9-10)21-18(24)17(23)20-14-7-5-4-6-13(14)16(19)22/h4-9H,1-3H3,(H2,19,22)(H,20,23)(H,21,24).
What are the key properties of N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide has a molecular weight of 325.37 g/mol, XLogP of 2.29, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide is sourced from PubChem (CID 108512277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).