N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide

C15H27N3O3 — CID 160804127

IUPACN-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide
SMILESC=C(C)N(C)C(=O)CC.C=CN(C)C(C)=O.C=CNC=O
InChIInChI=1S/C7H13NO.C5H9NO.C3H5NO/c1-5-7(9)8(4)6(2)3;1-4-6(3)5(2)7;1-2-4-3-5/h2,5H2,1,3-4H3;4H,1H2,2-3H3;2-3H,1H2,(H,4,5)
InChIKeySDLSNBUTYUFAKU-UHFFFAOYSA-N
MW297.40 g/mol
LogP1.87
Rot. Bonds5

About N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide

N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide (PubChem CID 160804127) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide.

Molecular Properties

Compound NameN-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide
PubChem CID160804127
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC NameN-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide
SMILESC=C(C)N(C)C(=O)CC.C=CN(C)C(C)=O.C=CNC=O
InChIInChI=1S/C7H13NO.C5H9NO.C3H5NO/c1-5-7(9)8(4)6(2)3;1-4-6(3)5(2)7;1-2-4-3-5/h2,5H2,1,3-4H3;4H,1H2,2-3H3;2-3H,1H2,(H,4,5)
InChIKeySDLSNBUTYUFAKU-UHFFFAOYSA-N
XLogP1.87
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(ethenylamino)but-3-enyl]-N-propan-2-ylpropanamide
CID 130253197
N-[(Z)-1-aminobut-1-en-2-yl]-N-methylpropanamide
CID 141994034
N-[2-[4-[ethenyl(formyl)amino]but-1-en-2-ylamino]ethyl]propanamide
CID 143947857
3-[[(E)-but-2-en-2-yl]-methylamino]-N-formylpropanamide
CID 156707047
N-ethenyl-N-ethylacetamide;N-ethenylpropanamide
CID 161727693

Frequently Asked Questions

What is the IUPAC name of N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide?
The IUPAC name of N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide (CID 160804127) is N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide.
What is the SMILES notation for N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide?
The canonical SMILES for N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide is C=C(C)N(C)C(=O)CC.C=CN(C)C(C)=O.C=CNC=O.
What is the InChIKey of N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide?
The InChIKey is SDLSNBUTYUFAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.C5H9NO.C3H5NO/c1-5-7(9)8(4)6(2)3;1-4-6(3)5(2)7;1-2-4-3-5/h2,5H2,1,3-4H3;4H,1H2,2-3H3;2-3H,1H2,(H,4,5).
What are the key properties of N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide?
N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide has a molecular weight of 297.40 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylformamide;N-ethenyl-N-methylacetamide;N-methyl-N-prop-1-en-2-ylpropanamide is sourced from PubChem (CID 160804127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).