N-ethylprop-2-enamide;N-methylmethanamine

C7H16N2O — CID 22381553

IUPACN-ethylprop-2-enamide;N-methylmethanamine
SMILESC=CC(=O)NCC.CNC
InChIInChI=1S/C5H9NO.C2H7N/c1-3-5(7)6-4-2;1-3-2/h3H,1,4H2,2H3,(H,6,7);3H,1-2H3
InChIKeyJOLNFGHBHWJGBH-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.14
Rot. Bonds2

About N-ethylprop-2-enamide;N-methylmethanamine

N-ethylprop-2-enamide;N-methylmethanamine (PubChem CID 22381553) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is N-ethylprop-2-enamide;N-methylmethanamine.

Molecular Properties

Compound NameN-ethylprop-2-enamide;N-methylmethanamine
PubChem CID22381553
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameN-ethylprop-2-enamide;N-methylmethanamine
SMILESC=CC(=O)NCC.CNC
InChIInChI=1S/C5H9NO.C2H7N/c1-3-5(7)6-4-2;1-3-2/h3H,1,4H2,2H3,(H,6,7);3H,1-2H3
InChIKeyJOLNFGHBHWJGBH-UHFFFAOYSA-N
XLogP0.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-ethylprop-2-enamide;N-methylprop-2-enamide;2-methylprop-1-ene
CID 91512805
(E)-N,N'-diethylbut-2-enediamide
CID 22015135
3,4-diamino-N-ethylbut-2-enamide;N-methylmethanamine
CID 173249574
molecular hydrogen;N-propylprop-2-enamide
CID 153372503
CID 173161904
CID 173161904
N-butylprop-2-enamide;N-ethylethanamine
CID 22596658
ethane;N-prop-2-enylprop-2-enamide
CID 142535548
but-1-ene;N-methylprop-2-enamide
CID 159446883
triethyl-[(prop-2-enoylamino)methyl]azanium
CID 87449059
N-butylprop-2-enamide;hydrofluoride
CID 174533496
N-[(E)-pent-2-enyl]prop-2-enamide
CID 131241342
N-[2-amino-2-(ethylamino)ethyl]prop-2-enamide
CID 138461440

Frequently Asked Questions

What is the IUPAC name of N-ethylprop-2-enamide;N-methylmethanamine?
The IUPAC name of N-ethylprop-2-enamide;N-methylmethanamine (CID 22381553) is N-ethylprop-2-enamide;N-methylmethanamine.
What is the SMILES notation for N-ethylprop-2-enamide;N-methylmethanamine?
The canonical SMILES for N-ethylprop-2-enamide;N-methylmethanamine is C=CC(=O)NCC.CNC.
What is the InChIKey of N-ethylprop-2-enamide;N-methylmethanamine?
The InChIKey is JOLNFGHBHWJGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C2H7N/c1-3-5(7)6-4-2;1-3-2/h3H,1,4H2,2H3,(H,6,7);3H,1-2H3.
What are the key properties of N-ethylprop-2-enamide;N-methylmethanamine?
N-ethylprop-2-enamide;N-methylmethanamine has a molecular weight of 144.22 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylprop-2-enamide;N-methylmethanamine is sourced from PubChem (CID 22381553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).