N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide

C14H26N2O3 — CID 108503625

IUPACN'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide
SMILESCCOCCCNC(=O)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C14H26N2O3/c1-3-19-11-7-10-15-13(17)14(18)16(2)12-8-5-4-6-9-12/h12H,3-11H2,1-2H3,(H,15,17)
InChIKeyGNQPXRFCCYPTCO-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.32
Rot. Bonds6

About N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide

N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide (PubChem CID 108503625) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide.

Molecular Properties

Compound NameN'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide
PubChem CID108503625
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide
SMILESCCOCCCNC(=O)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C14H26N2O3/c1-3-19-11-7-10-15-13(17)14(18)16(2)12-8-5-4-6-9-12/h12H,3-11H2,1-2H3,(H,15,17)
InChIKeyGNQPXRFCCYPTCO-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.32
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-(2-chloroethyl)-N'-cyclohexyl-N'-methyloxamide
CID 108503671
N-[3-(dimethylamino)propyl]-N'-(3-ethoxypropyl)oxamide
CID 108505282
N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide
CID 86848639
N-(3-ethoxypropyl)-N'-(2-methylcyclohexyl)oxamide
CID 108505284
cis-(1S,3R)-1-N,3-N-bis(3-ethoxypropyl)cyclohexane-1,3-dicarboxamide
CID 94820992
N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide
CID 54829340
N-(2-amino-2-sulfanylideneethyl)-N'-cyclopentyl-N'-methyloxamide
CID 43316466
N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide
CID 3226695
N'-(2-acetamidoethyl)-N-(3-ethoxypropyl)oxamide
CID 108505337
(Z)-3-(3-butoxypropylamino)-2-cyano-N-cyclohexyl-N-methylprop-2-enamide
CID 108830263
methyl 2-[cyclopentyl(4-ethoxybutanoyl)amino]acetate
CID 80709869
N-(3-ethoxypropyl)azepane-2-carboxamide
CID 64562798

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide?
The IUPAC name of N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide (CID 108503625) is N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide.
What is the SMILES notation for N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide?
The canonical SMILES for N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide is CCOCCCNC(=O)C(=O)N(C)C1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide?
The InChIKey is GNQPXRFCCYPTCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-3-19-11-7-10-15-13(17)14(18)16(2)12-8-5-4-6-9-12/h12H,3-11H2,1-2H3,(H,15,17).
What are the key properties of N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide?
N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide has a molecular weight of 270.37 g/mol, XLogP of 1.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N-(3-ethoxypropyl)-N'-methyloxamide is sourced from PubChem (CID 108503625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).