methoxyethane;N-methylethanamine;propane

C9H25NO — CID 91594601

IUPACmethoxyethane;N-methylethanamine;propane
SMILESCCC.CCNC.CCOC
InChIInChI=1S/C3H9N.C3H8O.C3H8/c2*1-3-4-2;1-3-2/h4H,3H2,1-2H3;3H2,1-2H3;3H2,1-2H3
InChIKeyBHVSOYHPQPRRRP-UHFFFAOYSA-N
MW163.30 g/mol
LogP2.29
Rot. Bonds2

About methoxyethane;N-methylethanamine;propane

methoxyethane;N-methylethanamine;propane (PubChem CID 91594601) has the molecular formula C9H25NO and a molecular weight of 163.30 g/mol. Its IUPAC name is methoxyethane;N-methylethanamine;propane.

Molecular Properties

Compound Namemethoxyethane;N-methylethanamine;propane
PubChem CID91594601
Molecular FormulaC9H25NO
Molecular Weight163.30 g/mol
Exact Mass163.19
IUPAC Namemethoxyethane;N-methylethanamine;propane
SMILESCCC.CCNC.CCOC
InChIInChI=1S/C3H9N.C3H8O.C3H8/c2*1-3-4-2;1-3-2/h4H,3H2,1-2H3;3H2,1-2H3;3H2,1-2H3
InChIKeyBHVSOYHPQPRRRP-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.30
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methoxyethane;N-methylethanamine;propane?
The IUPAC name of methoxyethane;N-methylethanamine;propane (CID 91594601) is methoxyethane;N-methylethanamine;propane.
What is the SMILES notation for methoxyethane;N-methylethanamine;propane?
The canonical SMILES for methoxyethane;N-methylethanamine;propane is CCC.CCNC.CCOC.
What is the InChIKey of methoxyethane;N-methylethanamine;propane?
The InChIKey is BHVSOYHPQPRRRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.C3H8O.C3H8/c2*1-3-4-2;1-3-2/h4H,3H2,1-2H3;3H2,1-2H3;3H2,1-2H3.
What are the key properties of methoxyethane;N-methylethanamine;propane?
methoxyethane;N-methylethanamine;propane has a molecular weight of 163.30 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethane;N-methylethanamine;propane is sourced from PubChem (CID 91594601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).