N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide

C13H22N2O2 — CID 18926047

IUPACN-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide
SMILESC=CN(C=O)CC(CC)(CC)CN(C=C)C=O
InChIInChI=1S/C13H22N2O2/c1-5-13(6-2,9-14(7-3)11-16)10-15(8-4)12-17/h7-8,11-12H,3-6,9-10H2,1-2H3
InChIKeyRJWOMUVEUZFGOI-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.00
Rot. Bonds10

About N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide

N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide (PubChem CID 18926047) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide.

Molecular Properties

Compound NameN-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide
PubChem CID18926047
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC NameN-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide
SMILESC=CN(C=O)CC(CC)(CC)CN(C=C)C=O
InChIInChI=1S/C13H22N2O2/c1-5-13(6-2,9-14(7-3)11-16)10-15(8-4)12-17/h7-8,11-12H,3-6,9-10H2,1-2H3
InChIKeyRJWOMUVEUZFGOI-UHFFFAOYSA-N
XLogP2.00
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethenyl-N-prop-2-enylformamide
CID 57465791
N-ethenyl-N-[11-[ethenyl(formyl)amino]-3,6,9-trihydroxyundecyl]formamide
CID 87349654
N-ethenyl-N-[(3-ethyloxetan-3-yl)methyl]formamide
CID 58338970
N-[2-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N-ethenylformamide
CID 58338973
N-(4,6-dimethylnonyl)-N-ethenylformamide
CID 167215588
N-(4,6-dimethyloctyl)-N-ethenylformamide
CID 155348936
N-ethenyl-N-[6-[ethenyl(formyl)amino]-3,5-dimethylhexyl]formamide
CID 89160347
N-(2,2-diethylpent-4-enyl)-N-ethylhydroxylamine
CID 155131371
2-ethyl-2-(hydroxymethyl)propane-1,3-diol;oxaldehydic acid;prop-2-enoic acid
CID 175462239
2-ethyl-2-(hydroxymethyl)propane-1,3-diol;formic acid
CID 159069506
2-ethyl-2-(hydroxymethyl)propane-1,3-diol;formic acid
CID 87346314
N,N-bis(4-methylpentan-2-yl)formamide
CID 57421709

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide?
The IUPAC name of N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide (CID 18926047) is N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide.
What is the SMILES notation for N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide?
The canonical SMILES for N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide is C=CN(C=O)CC(CC)(CC)CN(C=C)C=O.
What is the InChIKey of N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide?
The InChIKey is RJWOMUVEUZFGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-13(6-2,9-14(7-3)11-16)10-15(8-4)12-17/h7-8,11-12H,3-6,9-10H2,1-2H3.
What are the key properties of N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide?
N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide has a molecular weight of 238.33 g/mol, XLogP of 2.00, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-[2-[[ethenyl(formyl)amino]methyl]-2-ethylbutyl]formamide is sourced from PubChem (CID 18926047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).