ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine

C11H27NO — CID 143482022

IUPACethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
SMILESC=C(C)N(C)CCOC.CC.CC
InChIInChI=1S/C7H15NO.2C2H6/c1-7(2)8(3)5-6-9-4;2*1-2/h1,5-6H2,2-4H3;2*1-2H3
InChIKeyGDPDEFWULCYUEJ-UHFFFAOYSA-N
MW189.34 g/mol
LogP3.15
Rot. Bonds4

About ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine

ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine (PubChem CID 143482022) has the molecular formula C11H27NO and a molecular weight of 189.34 g/mol. Its IUPAC name is ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine.

Molecular Properties

Compound Nameethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
PubChem CID143482022
Molecular FormulaC11H27NO
Molecular Weight189.34 g/mol
Exact Mass189.21
IUPAC Nameethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
SMILESC=C(C)N(C)CCOC.CC.CC
InChIInChI=1S/C7H15NO.2C2H6/c1-7(2)8(3)5-6-9-4;2*1-2/h1,5-6H2,2-4H3;2*1-2H3
InChIKeyGDPDEFWULCYUEJ-UHFFFAOYSA-N
XLogP3.15
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.34
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine?
The IUPAC name of ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine (CID 143482022) is ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine.
What is the SMILES notation for ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine?
The canonical SMILES for ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine is C=C(C)N(C)CCOC.CC.CC.
What is the InChIKey of ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine?
The InChIKey is GDPDEFWULCYUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.2C2H6/c1-7(2)8(3)5-6-9-4;2*1-2/h1,5-6H2,2-4H3;2*1-2H3.
What are the key properties of ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine?
ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine has a molecular weight of 189.34 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine is sourced from PubChem (CID 143482022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).