ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine

C9H21NO — CID 169184703

IUPACethane;N-(2-methoxyethyl)-N-methylcyclopropanamine
SMILESCC.COCCN(C)C1CC1
InChIInChI=1S/C7H15NO.C2H6/c1-8(5-6-9-2)7-3-4-7;1-2/h7H,3-6H2,1-2H3;1-2H3
InChIKeyLHCRMMZLEMFQMJ-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.75
Rot. Bonds4

About ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine

ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine (PubChem CID 169184703) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine.

Molecular Properties

Compound Nameethane;N-(2-methoxyethyl)-N-methylcyclopropanamine
PubChem CID169184703
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Nameethane;N-(2-methoxyethyl)-N-methylcyclopropanamine
SMILESCC.COCCN(C)C1CC1
InChIInChI=1S/C7H15NO.C2H6/c1-8(5-6-9-2)7-3-4-7;1-2/h7H,3-6H2,1-2H3;1-2H3
InChIKeyLHCRMMZLEMFQMJ-UHFFFAOYSA-N
XLogP1.75
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 ≤ 51.75
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-methylcyclopropanamine?
The IUPAC name of ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine (CID 169184703) is ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine.
What is the SMILES notation for ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine?
The canonical SMILES for ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine is CC.COCCN(C)C1CC1.
What is the InChIKey of ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine?
The InChIKey is LHCRMMZLEMFQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C2H6/c1-8(5-6-9-2)7-3-4-7;1-2/h7H,3-6H2,1-2H3;1-2H3.
What are the key properties of ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine?
ethane;N-(2-methoxyethyl)-N-methylcyclopropanamine has a molecular weight of 159.27 g/mol, XLogP of 1.75, 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-methylcyclopropanamine is sourced from PubChem (CID 169184703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).