N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide

C18H26N2O2 — CID 108500534

IUPACN-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide
SMILESCC(C)c1ccccc1NC(=O)C(=O)NC1CCCCC1C
InChIInChI=1S/C18H26N2O2/c1-12(2)14-9-5-7-11-16(14)20-18(22)17(21)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15H,4,6,8,10H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyRLSTUCDNLVDYKR-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.44
Rot. Bonds3

About N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide

N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide (PubChem CID 108500534) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide
PubChem CID108500534
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide
SMILESCC(C)c1ccccc1NC(=O)C(=O)NC1CCCCC1C
InChIInChI=1S/C18H26N2O2/c1-12(2)14-9-5-7-11-16(14)20-18(22)17(21)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15H,4,6,8,10H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyRLSTUCDNLVDYKR-UHFFFAOYSA-N
XLogP3.44
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.44
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-tert-butylphenyl)-N-[(1R,2R)-2-methylcyclohexyl]oxamide
CID 124605766
N-(2-methylcyclohexyl)-N'-(2-morpholin-4-ylphenyl)oxamide
CID 108525006
N-(2-methylcyclohexyl)-N'-pyridin-2-yloxamide
CID 108524992
1-(2-methylcyclohexyl)-3-(2-methyl-6-propan-2-ylphenyl)urea
CID 47032242
N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
CID 63107606
N'-(2,4-dimethoxyphenyl)-N-(2-methylcyclohexyl)oxamide
CID 3220604
2-(2-propan-2-ylanilino)cyclohexan-1-ol
CID 60885259
2-methyl-N-(2-propan-2-ylphenyl)prop-2-enamide
CID 86076819
1-(3-methylcyclohexyl)-3-(2-propan-2-ylphenyl)urea
CID 47032083
N'-naphthalen-1-yl-N-(2-propan-2-ylphenyl)oxamide
CID 108500558
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144556
1-(2-methoxyphenyl)-3-[(1R,2R)-2-methylcyclohexyl]urea
CID 40636375

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide?
The IUPAC name of N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide (CID 108500534) is N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide.
What is the SMILES notation for N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide?
The canonical SMILES for N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide is CC(C)c1ccccc1NC(=O)C(=O)NC1CCCCC1C.
What is the InChIKey of N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide?
The InChIKey is RLSTUCDNLVDYKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-12(2)14-9-5-7-11-16(14)20-18(22)17(21)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15H,4,6,8,10H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide?
N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide has a molecular weight of 302.42 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide is sourced from PubChem (CID 108500534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).