N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide

C18H26N2O2 — CID 108503849

IUPACN-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide
SMILESCCN(C(=O)C(=O)N(C)C1CCCCC1)c1cccc(C)c1
InChIInChI=1S/C18H26N2O2/c1-4-20(16-12-8-9-14(2)13-16)18(22)17(21)19(3)15-10-6-5-7-11-15/h8-9,12-13,15H,4-7,10-11H2,1-3H3
InChIKeyOREFTJJPWMYFTF-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.14
Rot. Bonds3

About N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide

N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide (PubChem CID 108503849) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide.

Molecular Properties

Compound NameN-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide
PubChem CID108503849
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide
SMILESCCN(C(=O)C(=O)N(C)C1CCCCC1)c1cccc(C)c1
InChIInChI=1S/C18H26N2O2/c1-4-20(16-12-8-9-14(2)13-16)18(22)17(21)19(3)15-10-6-5-7-11-15/h8-9,12-13,15H,4-7,10-11H2,1-3H3
InChIKeyOREFTJJPWMYFTF-UHFFFAOYSA-N
XLogP3.14
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-ethyl-N-methyl-N'-(3-methylphenyl)-N-(1-methylpiperidin-4-yl)oxamide
CID 108507347
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 113159596
N-cyclohexyl-N-ethyl-3-methylaniline
CID 21396772
3-[cyclopentyl(methylsulfonyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 113137357
N-cyclopentyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108942305
3-[ethyl-(3-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782796
2-[cyclopropyl-[ethyl-(3-methylphenyl)carbamoyl]amino]acetic acid
CID 61206742
N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62212541
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605
3-amino-N-ethyl-N-(3-methylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119705842
N-ethyl-3-(2-ethylpiperidin-1-yl)-N-(3-methylphenyl)-3-oxopropanamide
CID 108952293

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide?
The IUPAC name of N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide (CID 108503849) is N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide.
What is the SMILES notation for N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide?
The canonical SMILES for N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide is CCN(C(=O)C(=O)N(C)C1CCCCC1)c1cccc(C)c1.
What is the InChIKey of N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide?
The InChIKey is OREFTJJPWMYFTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-4-20(16-12-8-9-14(2)13-16)18(22)17(21)19(3)15-10-6-5-7-11-15/h8-9,12-13,15H,4-7,10-11H2,1-3H3.
What are the key properties of N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide?
N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide has a molecular weight of 302.42 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide is sourced from PubChem (CID 108503849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).