N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide

C13H24N2O2 — CID 108504857

IUPACN'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide
SMILESCC(C)CNC(=O)C(=O)NC1CCCCC1C
InChIInChI=1S/C13H24N2O2/c1-9(2)8-14-12(16)13(17)15-11-7-5-4-6-10(11)3/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyLWCRTDOJVZQSOO-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.45
Rot. Bonds3

About N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide

N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide (PubChem CID 108504857) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide.

Molecular Properties

Compound NameN'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide
PubChem CID108504857
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide
SMILESCC(C)CNC(=O)C(=O)NC1CCCCC1C
InChIInChI=1S/C13H24N2O2/c1-9(2)8-14-12(16)13(17)15-11-7-5-4-6-10(11)3/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyLWCRTDOJVZQSOO-UHFFFAOYSA-N
XLogP1.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.45
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'-[(2R)-butan-2-yl]-N-[(1S,2S)-2-methylcyclohexyl]oxamide
CID 11897539
N'-[(1R,2S)-2-methylcyclohexyl]oxamide
CID 124605602
N-(3-ethoxypropyl)-N'-(2-methylcyclohexyl)oxamide
CID 108505284
N-[2-(2-hydroxyethoxy)ethyl]-N'-(2-methylcyclohexyl)oxamide
CID 108524266
(2S)-2-amino-4-methyl-N-(2-methylcyclopentyl)pentanamide
CID 63281509
3-(ethylamino)-2-methyl-N-(2-methylcyclohexyl)propanamide
CID 62853775
1-(2-methylcycloheptyl)-3-propan-2-ylurea
CID 115660988
1-ethyl-3-(2-methylcyclohexyl)urea
CID 112682943
N'-[(1S,2R)-2-methylcyclohexyl]-N-[(2-methylphenyl)methyl]oxamide
CID 125145081
ethyl 2-[(2-methylcyclohexyl)amino]-2-oxoacetate
CID 60895559
N'-[(1S,2S)-2-methylcyclohexyl]-N-(pyridin-2-ylmethyl)oxamide
CID 124605707
N'-[(1S,2R)-2-methylcyclohexyl]-N-(3-phenylpropyl)oxamide
CID 125145050

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide?
The IUPAC name of N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide (CID 108504857) is N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide.
What is the SMILES notation for N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide?
The canonical SMILES for N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide is CC(C)CNC(=O)C(=O)NC1CCCCC1C.
What is the InChIKey of N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide?
The InChIKey is LWCRTDOJVZQSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9(2)8-14-12(16)13(17)15-11-7-5-4-6-10(11)3/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide?
N'-(2-methylcyclohexyl)-N-(2-methylpropyl)oxamide has a molecular weight of 240.35 g/mol, XLogP of 1.45, 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-methylpropyl)oxamide is sourced from PubChem (CID 108504857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).