1-(azetidin-3-yl)-2-methylazetidin-3-ol

C7H14N2O — CID 162505403

IUPAC1-(azetidin-3-yl)-2-methylazetidin-3-ol
SMILESCC1C(O)CN1C1CNC1
InChIInChI=1S/C7H14N2O/c1-5-7(10)4-9(5)6-2-8-3-6/h5-8,10H,2-4H2,1H3
InChIKeyUSVZGZJNWZIOOQ-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.98
Rot. Bonds1

About 1-(azetidin-3-yl)-2-methylazetidin-3-ol

1-(azetidin-3-yl)-2-methylazetidin-3-ol (PubChem CID 162505403) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-2-methylazetidin-3-ol.

Molecular Properties

Compound Name1-(azetidin-3-yl)-2-methylazetidin-3-ol
PubChem CID162505403
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-(azetidin-3-yl)-2-methylazetidin-3-ol
SMILESCC1C(O)CN1C1CNC1
InChIInChI=1S/C7H14N2O/c1-5-7(10)4-9(5)6-2-8-3-6/h5-8,10H,2-4H2,1H3
InChIKeyUSVZGZJNWZIOOQ-UHFFFAOYSA-N
XLogP-0.98
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(azetidin-3-yl)pyrrolidine-3,4-diol
CID 106674356
(3S,5R)-1-(azetidin-3-yl)-5-methylpiperidin-3-ol
CID 130802727
[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102789766
1-[4-(azetidin-3-yl)-3-methylpiperazin-1-yl]ethanone;hydrochloride
CID 130878732
(6R,7R,10aR)-2,6,7-trimethyl-3,4,6,7,8,9,10,10a-octahydro-1H-pyrazino[1,2-a][1,4]diazepine
CID 177261861
(3R,4R)-4-methylpyrrolidin-3-ol;hydrochloride
CID 67314821
4-methyl-1-pyrrolidin-3-ylpiperidin-3-ol
CID 102969108
4-(3,5-dimethylpiperidin-1-yl)pyrrolidin-3-ol
CID 63703405
(2R,3R,4S)-1-hydroxy-2-methylpyrrolidine-3,4-diol
CID 89313311
1-O-tert-butyl 3-O-methyl 4-(azetidin-3-yl)piperazine-1,3-dicarboxylate
CID 171506198
1-(azetidin-3-yl)pyrrolidin-3-ol
CID 55278856
(3S,4R,5S)-5-methylpiperidine-3,4-diol;hydrochloride
CID 146675644

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-2-methylazetidin-3-ol?
The IUPAC name of 1-(azetidin-3-yl)-2-methylazetidin-3-ol (CID 162505403) is 1-(azetidin-3-yl)-2-methylazetidin-3-ol.
What is the SMILES notation for 1-(azetidin-3-yl)-2-methylazetidin-3-ol?
The canonical SMILES for 1-(azetidin-3-yl)-2-methylazetidin-3-ol is CC1C(O)CN1C1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-2-methylazetidin-3-ol?
The InChIKey is USVZGZJNWZIOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-5-7(10)4-9(5)6-2-8-3-6/h5-8,10H,2-4H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-2-methylazetidin-3-ol?
1-(azetidin-3-yl)-2-methylazetidin-3-ol has a molecular weight of 142.20 g/mol, XLogP of -0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-2-methylazetidin-3-ol is sourced from PubChem (CID 162505403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).