ethane;3-methylazetidine

C6H15N — CID 90730870

IUPACethane;3-methylazetidine
SMILESCC.CC1CNC1
InChIInChI=1S/C4H9N.C2H6/c1-4-2-5-3-4;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyOAMPZQVLEVNWAJ-UHFFFAOYSA-N
MW101.19 g/mol
LogP1.25
Rot. Bonds

About ethane;3-methylazetidine

ethane;3-methylazetidine (PubChem CID 90730870) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is ethane;3-methylazetidine.

Molecular Properties

Compound Nameethane;3-methylazetidine
PubChem CID90730870
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC Nameethane;3-methylazetidine
SMILESCC.CC1CNC1
InChIInChI=1S/C4H9N.C2H6/c1-4-2-5-3-4;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyOAMPZQVLEVNWAJ-UHFFFAOYSA-N
XLogP1.25
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.19
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethane;3-methylazetidine?
The IUPAC name of ethane;3-methylazetidine (CID 90730870) is ethane;3-methylazetidine.
What is the SMILES notation for ethane;3-methylazetidine?
The canonical SMILES for ethane;3-methylazetidine is CC.CC1CNC1.
What is the InChIKey of ethane;3-methylazetidine?
The InChIKey is OAMPZQVLEVNWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.C2H6/c1-4-2-5-3-4;1-2/h4-5H,2-3H2,1H3;1-2H3.
What are the key properties of ethane;3-methylazetidine?
ethane;3-methylazetidine has a molecular weight of 101.19 g/mol, XLogP of 1.25, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methylazetidine is sourced from PubChem (CID 90730870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).