N-cyclohexyl-N',N'-di(propan-2-yl)oxamide

C14H26N2O2 — CID 14925041

IUPACN-cyclohexyl-N',N'-di(propan-2-yl)oxamide
SMILESCC(C)N(C(=O)C(=O)NC1CCCCC1)C(C)C
InChIInChI=1S/C14H26N2O2/c1-10(2)16(11(3)4)14(18)13(17)15-12-8-6-5-7-9-12/h10-12H,5-9H2,1-4H3,(H,15,17)
InChIKeyZPWLIMLKHGDDLI-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.08
Rot. Bonds3

About N-cyclohexyl-N',N'-di(propan-2-yl)oxamide

N-cyclohexyl-N',N'-di(propan-2-yl)oxamide (PubChem CID 14925041) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-cyclohexyl-N',N'-di(propan-2-yl)oxamide.

Molecular Properties

Compound NameN-cyclohexyl-N',N'-di(propan-2-yl)oxamide
PubChem CID14925041
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-cyclohexyl-N',N'-di(propan-2-yl)oxamide
SMILESCC(C)N(C(=O)C(=O)NC1CCCCC1)C(C)C
InChIInChI=1S/C14H26N2O2/c1-10(2)16(11(3)4)14(18)13(17)15-12-8-6-5-7-9-12/h10-12H,5-9H2,1-4H3,(H,15,17)
InChIKeyZPWLIMLKHGDDLI-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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N-acetylglycyl-N-cyclohexylisovalinamide
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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N',N'-di(propan-2-yl)oxamide?
The IUPAC name of N-cyclohexyl-N',N'-di(propan-2-yl)oxamide (CID 14925041) is N-cyclohexyl-N',N'-di(propan-2-yl)oxamide.
What is the SMILES notation for N-cyclohexyl-N',N'-di(propan-2-yl)oxamide?
The canonical SMILES for N-cyclohexyl-N',N'-di(propan-2-yl)oxamide is CC(C)N(C(=O)C(=O)NC1CCCCC1)C(C)C.
What is the InChIKey of N-cyclohexyl-N',N'-di(propan-2-yl)oxamide?
The InChIKey is ZPWLIMLKHGDDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-10(2)16(11(3)4)14(18)13(17)15-12-8-6-5-7-9-12/h10-12H,5-9H2,1-4H3,(H,15,17).
What are the key properties of N-cyclohexyl-N',N'-di(propan-2-yl)oxamide?
N-cyclohexyl-N',N'-di(propan-2-yl)oxamide has a molecular weight of 254.37 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N',N'-di(propan-2-yl)oxamide is sourced from PubChem (CID 14925041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).