N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide

C17H26N2O2 — CID 108512105

IUPACN-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1c(C)cccc1CC
InChIInChI=1S/C17H26N2O2/c1-5-11-19(12-6-2)17(21)16(20)18-15-13(4)9-8-10-14(15)7-3/h8-10H,5-7,11-12H2,1-4H3,(H,18,20)
InChIKeyQIEZZFRHOKXZIH-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.14
Rot. Bonds6

About N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide

N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide (PubChem CID 108512105) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide
PubChem CID108512105
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1c(C)cccc1CC
InChIInChI=1S/C17H26N2O2/c1-5-11-19(12-6-2)17(21)16(20)18-15-13(4)9-8-10-14(15)7-3/h8-10H,5-7,11-12H2,1-4H3,(H,18,20)
InChIKeyQIEZZFRHOKXZIH-UHFFFAOYSA-N
XLogP3.14
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.14
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

N-(2-ethyl-6-methylphenyl)-N',N'-bis(2-methylpropyl)oxamide
CID 108512129
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N-(2-ethyl-6-methylphenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108512103
(Z)-2-cyano-3-(dipropylamino)-N-(2-ethyl-6-methylphenyl)prop-2-enamide
CID 108850857
N'-butyl-N-(2,3-dimethylphenyl)-N'-propyloxamide
CID 108515302
(E)-N,N'-bis(2-ethyl-6-methylphenyl)but-2-enediamide
CID 17407260
N',N'-dibenzyl-N-(2,6-dimethylphenyl)oxamide
CID 108523708
(Z)-2-cyano-3-(dibutylamino)-N-(2-ethyl-6-methylphenyl)prop-2-enamide
CID 108850816
1,1-dibenzyl-3-(2-ethyl-6-methylphenyl)urea
CID 3835143
2-(2,6-diethylanilino)-N,N-dipropylacetamide
CID 109006644
(Z)-3-[butyl(methyl)amino]-2-cyano-N-(2-ethyl-6-methylphenyl)prop-2-enamide
CID 108850855
N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide
CID 108528705

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide (CID 108512105) is N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide is CCCN(CCC)C(=O)C(=O)Nc1c(C)cccc1CC.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide?
The InChIKey is QIEZZFRHOKXZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-5-11-19(12-6-2)17(21)16(20)18-15-13(4)9-8-10-14(15)7-3/h8-10H,5-7,11-12H2,1-4H3,(H,18,20).
What are the key properties of N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide?
N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide has a molecular weight of 290.41 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide is sourced from PubChem (CID 108512105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).