N-methyl-N-prop-1-enylformamide

C5H9NO — CID 141076555

IUPACN-methyl-N-prop-1-enylformamide
SMILESCC=CN(C)C=O
InChIInChI=1S/C5H9NO/c1-3-4-6(2)5-7/h3-5H,1-2H3
InChIKeyUAYBRSBTMIOKCO-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.61
Rot. Bonds2

About N-methyl-N-prop-1-enylformamide

N-methyl-N-prop-1-enylformamide (PubChem CID 141076555) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is N-methyl-N-prop-1-enylformamide.

Molecular Properties

Compound NameN-methyl-N-prop-1-enylformamide
PubChem CID141076555
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC NameN-methyl-N-prop-1-enylformamide
SMILESCC=CN(C)C=O
InChIInChI=1S/C5H9NO/c1-3-4-6(2)5-7/h3-5H,1-2H3
InChIKeyUAYBRSBTMIOKCO-UHFFFAOYSA-N
XLogP0.61
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-penta-1,3-dienylformamide
CID 123920122
N-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]-N-methylformamide
CID 89354713
N-methyl-N-[(Z)-2-(methylamino)ethenyl]formamide
CID 143224157
N-[(1E)-buta-1,3-dienyl]-N-methylformamide
CID 58812160
N-ethenyl-N-methylprop-1-en-1-amine
CID 72587772
(E)-N-ethenyl-N-methylprop-1-en-1-amine
CID 18732256
N-(3-aminoprop-1-enyl)-N-methylformamide
CID 173464969
CID 159352431
CID 159352431
(Z)-N,3-dimethyl-N-[(Z)-prop-1-enyl]but-1-en-1-amine;ethane
CID 142053710
N,N-bis(prop-1-enyl)acetamide
CID 85447022
N-[(1Z,3Z)-2-ethylpenta-1,3-dienyl]-N-methylformamide
CID 166958378
N,N-dimethylformamide;dimethyl(oxo)silane
CID 159656610

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-prop-1-enylformamide?
The IUPAC name of N-methyl-N-prop-1-enylformamide (CID 141076555) is N-methyl-N-prop-1-enylformamide.
What is the SMILES notation for N-methyl-N-prop-1-enylformamide?
The canonical SMILES for N-methyl-N-prop-1-enylformamide is CC=CN(C)C=O.
What is the InChIKey of N-methyl-N-prop-1-enylformamide?
The InChIKey is UAYBRSBTMIOKCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c1-3-4-6(2)5-7/h3-5H,1-2H3.
What are the key properties of N-methyl-N-prop-1-enylformamide?
N-methyl-N-prop-1-enylformamide has a molecular weight of 99.13 g/mol, XLogP of 0.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-1-enylformamide is sourced from PubChem (CID 141076555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).