3-(Propan-2-yl)azetidine hydrochloride

C6H14ClN — CID 71757114

IUPAC3-propan-2-ylazetidine;hydrochloride
SMILESCC(C)C1CNC1.Cl
InChIInChI=1S/C6H13N.ClH/c1-5(2)6-3-7-4-6;/h5-7H,3-4H2,1-2H3;1H
InChIKeyPCMYOLGVIVGJBO-UHFFFAOYSA-N
MW135.63 g/mol
LogP—
Rot. Bonds1

About 3-(Propan-2-yl)azetidine hydrochloride

3-(Propan-2-yl)azetidine hydrochloride (PubChem CID 71757114) has the molecular formula C6H14ClN and a molecular weight of 135.63 g/mol. Its IUPAC name is 3-propan-2-ylazetidine;hydrochloride.

Molecular Properties

Compound Name3-(Propan-2-yl)azetidine hydrochloride
PubChem CID71757114
Molecular FormulaC6H14ClN
Molecular Weight135.63 g/mol
Exact Mass135.08
IUPAC Name3-propan-2-ylazetidine;hydrochloride
SMILESCC(C)C1CNC1.Cl
InChIInChI=1S/C6H13N.ClH/c1-5(2)6-3-7-4-6;/h5-7H,3-4H2,1-2H3;1H
InChIKeyPCMYOLGVIVGJBO-UHFFFAOYSA-N
XLogP—
TPSA12.00 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity55

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-Methylazetidine hydrochloride
CID 25159188
2,3-Dimethylazetidine hydrochloride
CID 119056904
3-(1,1-Difluoroethyl)azetidine hydrochloride
CID 137951733
3-(2-Fluoropropan-2-yl)azetidine hydrochloride
CID 145913541
2,2,3-Trimethylazetidine hydrochloride
CID 167730011
3-methylAzetidine
CID 19995942
2,3-Dimethylazetidine
CID 55256068
3-Tert-butylazetidine hydrochloride
CID 121553156
3-(Butan-2-yl)azetidine hydrochloride
CID 126845859
3-(2-Methylpropyl)azetidine hydrochloride
CID 137951741
[2-(Azetidin-3-yl)ethyl]dimethylamine dihydrochloride
CID 145874443
3-Isopropyl-3-methyl-azetidine;hydrochloride
CID 177800513

Frequently Asked Questions

What is the IUPAC name of 3-(Propan-2-yl)azetidine hydrochloride?
The IUPAC name of 3-(Propan-2-yl)azetidine hydrochloride (CID 71757114) is 3-propan-2-ylazetidine;hydrochloride.
What is the SMILES notation for 3-(Propan-2-yl)azetidine hydrochloride?
The canonical SMILES for 3-(Propan-2-yl)azetidine hydrochloride is CC(C)C1CNC1.Cl.
What is the InChIKey of 3-(Propan-2-yl)azetidine hydrochloride?
The InChIKey is PCMYOLGVIVGJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.ClH/c1-5(2)6-3-7-4-6;/h5-7H,3-4H2,1-2H3;1H.
What are the key properties of 3-(Propan-2-yl)azetidine hydrochloride?
3-(Propan-2-yl)azetidine hydrochloride has a molecular weight of 135.63 g/mol, XLogP of not available, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(Propan-2-yl)azetidine hydrochloride is sourced from PubChem (CID 71757114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).