N',N'-dibutyl-N-(2-methoxyethyl)oxamide

C13H26N2O3 — CID 108504989

IUPACN',N'-dibutyl-N-(2-methoxyethyl)oxamide
SMILESCCCCN(CCCC)C(=O)C(=O)NCCOC
InChIInChI=1S/C13H26N2O3/c1-4-6-9-15(10-7-5-2)13(17)12(16)14-8-11-18-3/h4-11H2,1-3H3,(H,14,16)
InChIKeyVZNAUIABEQBRJP-UHFFFAOYSA-N
MW258.36 g/mol
LogP1.18
Rot. Bonds9

About N',N'-dibutyl-N-(2-methoxyethyl)oxamide

N',N'-dibutyl-N-(2-methoxyethyl)oxamide (PubChem CID 108504989) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N',N'-dibutyl-N-(2-methoxyethyl)oxamide.

Molecular Properties

Compound NameN',N'-dibutyl-N-(2-methoxyethyl)oxamide
PubChem CID108504989
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN',N'-dibutyl-N-(2-methoxyethyl)oxamide
SMILESCCCCN(CCCC)C(=O)C(=O)NCCOC
InChIInChI=1S/C13H26N2O3/c1-4-6-9-15(10-7-5-2)13(17)12(16)14-8-11-18-3/h4-11H2,1-3H3,(H,14,16)
InChIKeyVZNAUIABEQBRJP-UHFFFAOYSA-N
XLogP1.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-butyl-N-(2-methoxyethyl)-N'-methyloxamide
CID 108505015
N',N'-dibutyl-N-(2-hydroxyethyl)oxamide
CID 108524538
N'-butyl-N-ethyl-N'-propyloxamide
CID 108521406
N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)oxamide
CID 108505035
2-[butyl(methyl)amino]-N-(2-methoxyethyl)acetamide
CID 108994026
N'-butyl-N-prop-2-enyl-N'-propyloxamide
CID 108521545
N-(2-methoxyethyl)-2-oxobutanamide
CID 141125375
3-[acetyl(butyl)amino]-N-(3-methoxypropyl)propanamide
CID 113115724
2-[acetyl(3-methoxypropyl)amino]-N-butylacetamide
CID 113159992
2-hydrazinyl-N,N-bis(2-methoxyethyl)-2-oxoacetamide
CID 61418318
2-[acetyl(propyl)amino]-N-(2-methoxyethyl)acetamide
CID 113157913
1-butyl-1-ethyl-3-(3-methoxypropyl)thiourea
CID 115570268

Frequently Asked Questions

What is the IUPAC name of N',N'-dibutyl-N-(2-methoxyethyl)oxamide?
The IUPAC name of N',N'-dibutyl-N-(2-methoxyethyl)oxamide (CID 108504989) is N',N'-dibutyl-N-(2-methoxyethyl)oxamide.
What is the SMILES notation for N',N'-dibutyl-N-(2-methoxyethyl)oxamide?
The canonical SMILES for N',N'-dibutyl-N-(2-methoxyethyl)oxamide is CCCCN(CCCC)C(=O)C(=O)NCCOC.
What is the InChIKey of N',N'-dibutyl-N-(2-methoxyethyl)oxamide?
The InChIKey is VZNAUIABEQBRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-4-6-9-15(10-7-5-2)13(17)12(16)14-8-11-18-3/h4-11H2,1-3H3,(H,14,16).
What are the key properties of N',N'-dibutyl-N-(2-methoxyethyl)oxamide?
N',N'-dibutyl-N-(2-methoxyethyl)oxamide has a molecular weight of 258.36 g/mol, XLogP of 1.18, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dibutyl-N-(2-methoxyethyl)oxamide is sourced from PubChem (CID 108504989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).