ethane;3-ethyl-3-methyloxetane;methanamine

C9H23NO — CID 142501771

IUPACethane;3-ethyl-3-methyloxetane;methanamine
SMILESCC.CCC1(C)COC1.CN
InChIInChI=1S/C6H12O.C2H6.CH5N/c1-3-6(2)4-7-5-6;2*1-2/h3-5H2,1-2H3;1-2H3;2H2,1H3
InChIKeyDUXQNGJLKXTUHC-UHFFFAOYSA-N
MW161.29 g/mol
LogP2.03
Rot. Bonds1

About ethane;3-ethyl-3-methyloxetane;methanamine

ethane;3-ethyl-3-methyloxetane;methanamine (PubChem CID 142501771) has the molecular formula C9H23NO and a molecular weight of 161.29 g/mol. Its IUPAC name is ethane;3-ethyl-3-methyloxetane;methanamine.

Molecular Properties

Compound Nameethane;3-ethyl-3-methyloxetane;methanamine
PubChem CID142501771
Molecular FormulaC9H23NO
Molecular Weight161.29 g/mol
Exact Mass161.18
IUPAC Nameethane;3-ethyl-3-methyloxetane;methanamine
SMILESCC.CCC1(C)COC1.CN
InChIInChI=1S/C6H12O.C2H6.CH5N/c1-3-6(2)4-7-5-6;2*1-2/h3-5H2,1-2H3;1-2H3;2H2,1H3
InChIKeyDUXQNGJLKXTUHC-UHFFFAOYSA-N
XLogP2.03
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.29
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-3-methyloxetane;methanamine?
The IUPAC name of ethane;3-ethyl-3-methyloxetane;methanamine (CID 142501771) is ethane;3-ethyl-3-methyloxetane;methanamine.
What is the SMILES notation for ethane;3-ethyl-3-methyloxetane;methanamine?
The canonical SMILES for ethane;3-ethyl-3-methyloxetane;methanamine is CC.CCC1(C)COC1.CN.
What is the InChIKey of ethane;3-ethyl-3-methyloxetane;methanamine?
The InChIKey is DUXQNGJLKXTUHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.C2H6.CH5N/c1-3-6(2)4-7-5-6;2*1-2/h3-5H2,1-2H3;1-2H3;2H2,1H3.
What are the key properties of ethane;3-ethyl-3-methyloxetane;methanamine?
ethane;3-ethyl-3-methyloxetane;methanamine has a molecular weight of 161.29 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-3-methyloxetane;methanamine is sourced from PubChem (CID 142501771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).