N,N-dimethyloxetan-3-amine;ethane

C7H17NO — CID 142330300

IUPACN,N-dimethyloxetan-3-amine;ethane
SMILESCC.CN(C)C1COC1
InChIInChI=1S/C5H11NO.C2H6/c1-6(2)5-3-7-4-5;1-2/h5H,3-4H2,1-2H3;1-2H3
InChIKeyMPEHXFYDPADQTE-UHFFFAOYSA-N
MW131.22 g/mol
LogP0.97
Rot. Bonds1

About N,N-dimethyloxetan-3-amine;ethane

N,N-dimethyloxetan-3-amine;ethane (PubChem CID 142330300) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is N,N-dimethyloxetan-3-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyloxetan-3-amine;ethane
PubChem CID142330300
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC NameN,N-dimethyloxetan-3-amine;ethane
SMILESCC.CN(C)C1COC1
InChIInChI=1S/C5H11NO.C2H6/c1-6(2)5-3-7-4-5;1-2/h5H,3-4H2,1-2H3;1-2H3
InChIKeyMPEHXFYDPADQTE-UHFFFAOYSA-N
XLogP0.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyloxetan-3-amine;ethane?
The IUPAC name of N,N-dimethyloxetan-3-amine;ethane (CID 142330300) is N,N-dimethyloxetan-3-amine;ethane.
What is the SMILES notation for N,N-dimethyloxetan-3-amine;ethane?
The canonical SMILES for N,N-dimethyloxetan-3-amine;ethane is CC.CN(C)C1COC1.
What is the InChIKey of N,N-dimethyloxetan-3-amine;ethane?
The InChIKey is MPEHXFYDPADQTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C2H6/c1-6(2)5-3-7-4-5;1-2/h5H,3-4H2,1-2H3;1-2H3.
What are the key properties of N,N-dimethyloxetan-3-amine;ethane?
N,N-dimethyloxetan-3-amine;ethane has a molecular weight of 131.22 g/mol, XLogP of 0.97, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyloxetan-3-amine;ethane is sourced from PubChem (CID 142330300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).