azetidine;propane

C6H15N — CID 91117191

IUPACazetidine;propane
SMILESC1CNC1.CCC
InChIInChI=1S/C3H7N.C3H8/c1-2-4-3-1;1-3-2/h4H,1-3H2;3H2,1-2H3
InChIKeyURAYBXMCMIFFRW-UHFFFAOYSA-N
MW101.19 g/mol
LogP1.40
Rot. Bonds

About azetidine;propane

azetidine;propane (PubChem CID 91117191) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is azetidine;propane.

Molecular Properties

Compound Nameazetidine;propane
PubChem CID91117191
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC Nameazetidine;propane
SMILESC1CNC1.CCC
InChIInChI=1S/C3H7N.C3H8/c1-2-4-3-1;1-3-2/h4H,1-3H2;3H2,1-2H3
InChIKeyURAYBXMCMIFFRW-UHFFFAOYSA-N
XLogP1.40
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 ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azetidine;propane?
The IUPAC name of azetidine;propane (CID 91117191) is azetidine;propane.
What is the SMILES notation for azetidine;propane?
The canonical SMILES for azetidine;propane is C1CNC1.CCC.
What is the InChIKey of azetidine;propane?
The InChIKey is URAYBXMCMIFFRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N.C3H8/c1-2-4-3-1;1-3-2/h4H,1-3H2;3H2,1-2H3.
What are the key properties of azetidine;propane?
azetidine;propane has a molecular weight of 101.19 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azetidine;propane is sourced from PubChem (CID 91117191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).