1-(dimethylamino)ethenol;N,N-dimethylmethanamine

C7H18N2O — CID 144847979

IUPAC1-(dimethylamino)ethenol;N,N-dimethylmethanamine
SMILESC=C(O)N(C)C.CN(C)C
InChIInChI=1S/C4H9NO.C3H9N/c1-4(6)5(2)3;1-4(2)3/h6H,1H2,2-3H3;1-3H3
InChIKeyZDJUGFMVXSGJRH-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.75
Rot. Bonds1

About 1-(dimethylamino)ethenol;N,N-dimethylmethanamine

1-(dimethylamino)ethenol;N,N-dimethylmethanamine (PubChem CID 144847979) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-(dimethylamino)ethenol;N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(dimethylamino)ethenol;N,N-dimethylmethanamine
PubChem CID144847979
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Name1-(dimethylamino)ethenol;N,N-dimethylmethanamine
SMILESC=C(O)N(C)C.CN(C)C
InChIInChI=1S/C4H9NO.C3H9N/c1-4(6)5(2)3;1-4(2)3/h6H,1H2,2-3H3;1-3H3
InChIKeyZDJUGFMVXSGJRH-UHFFFAOYSA-N
XLogP0.75
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)ethenol;N,N-dimethylmethanamine?
The IUPAC name of 1-(dimethylamino)ethenol;N,N-dimethylmethanamine (CID 144847979) is 1-(dimethylamino)ethenol;N,N-dimethylmethanamine.
What is the SMILES notation for 1-(dimethylamino)ethenol;N,N-dimethylmethanamine?
The canonical SMILES for 1-(dimethylamino)ethenol;N,N-dimethylmethanamine is C=C(O)N(C)C.CN(C)C.
What is the InChIKey of 1-(dimethylamino)ethenol;N,N-dimethylmethanamine?
The InChIKey is ZDJUGFMVXSGJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C3H9N/c1-4(6)5(2)3;1-4(2)3/h6H,1H2,2-3H3;1-3H3.
What are the key properties of 1-(dimethylamino)ethenol;N,N-dimethylmethanamine?
1-(dimethylamino)ethenol;N,N-dimethylmethanamine has a molecular weight of 146.23 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)ethenol;N,N-dimethylmethanamine is sourced from PubChem (CID 144847979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).