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

C9H21NO — CID 144716365

IUPACethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
SMILESC=C(C)N(C)CCOC.CC
InChIInChI=1S/C7H15NO.C2H6/c1-7(2)8(3)5-6-9-4;1-2/h1,5-6H2,2-4H3;1-2H3
InChIKeyRJCYQTNXQAQUPM-UHFFFAOYSA-N
MW159.27 g/mol
LogP2.12
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 144716365) has the molecular formula C9H21NO and a molecular weight of 159.27 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 CID144716365
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Nameethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
SMILESC=C(C)N(C)CCOC.CC
InChIInChI=1S/C7H15NO.C2H6/c1-7(2)8(3)5-6-9-4;1-2/h1,5-6H2,2-4H3;1-2H3
InChIKeyRJCYQTNXQAQUPM-UHFFFAOYSA-N
XLogP2.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 52.12
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 144716365) 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.
What is the InChIKey of ethane;N-(2-methoxyethyl)-N-methylprop-1-en-2-amine?
The InChIKey is RJCYQTNXQAQUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C2H6/c1-7(2)8(3)5-6-9-4;1-2/h1,5-6H2,2-4H3;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 159.27 g/mol, XLogP of 2.12, 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 144716365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).