N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide

C18H19ClN2O2 — CID 108512069

IUPACN-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
SMILESCCc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1C
InChIInChI=1S/C18H19ClN2O2/c1-4-13-7-5-6-11(2)16(13)21-18(23)17(22)20-15-9-8-14(19)10-12(15)3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyYZBCCKFUEUWNNM-UHFFFAOYSA-N
MW330.82 g/mol
LogP4.10
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide

N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide (PubChem CID 108512069) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
PubChem CID108512069
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
SMILESCCc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1C
InChIInChI=1S/C18H19ClN2O2/c1-4-13-7-5-6-11(2)16(13)21-18(23)17(22)20-15-9-8-14(19)10-12(15)3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyYZBCCKFUEUWNNM-UHFFFAOYSA-N
XLogP4.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-ethyl-6-methylphenyl)-N-(4-iodo-2-methylphenyl)oxamide
CID 108512029
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N-(2,5-dichlorophenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108500926
N-(2,4-dichlorophenyl)-N'-(2-ethyl-6-methylphenyl)propanediamide
CID 108954244
2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 2649472
2,4-dichloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 779360
5-chloro-2-(2-ethyl-6-methylanilino)benzoic acid
CID 63528499
N'-(2,6-diethylphenyl)-N-(2,3-dimethylphenyl)oxamide
CID 108511380
1-(4-chloro-2-methylphenyl)-3-(2-methylphenyl)urea
CID 108894172
N-(3-bromo-4-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
CID 108986918
N-(4-chloro-2-methylphenyl)-3-(2,6-dimethylanilino)propanamide
CID 109035866
2-(N-acetyl-4-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 113172088

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide (CID 108512069) is N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide is CCc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1C.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide?
The InChIKey is YZBCCKFUEUWNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-4-13-7-5-6-11(2)16(13)21-18(23)17(22)20-15-9-8-14(19)10-12(15)3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide?
N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide has a molecular weight of 330.82 g/mol, XLogP of 4.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide is sourced from PubChem (CID 108512069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).