(2R,3S)-2-methylazetidin-3-ol;hydrochloride

C4H10ClNO — CID 134691791

IUPAC(2R,3S)-2-methylazetidin-3-ol;hydrochloride
SMILESC[C@H]1NC[C@@H]1O.Cl
InChIInChI=1S/C4H9NO.ClH/c1-3-4(6)2-5-3;/h3-6H,2H2,1H3;1H/t3-,4+;/m1./s1
InChIKeyVGWXJFDIRONLQP-HJXLNUONSA-N
MW123.58 g/mol
LogP-0.24
Rot. Bonds

About (2R,3S)-2-methylazetidin-3-ol;hydrochloride

(2R,3S)-2-methylazetidin-3-ol;hydrochloride (PubChem CID 134691791) has the molecular formula C4H10ClNO and a molecular weight of 123.58 g/mol. Its IUPAC name is (2R,3S)-2-methylazetidin-3-ol;hydrochloride.

Molecular Properties

Compound Name(2R,3S)-2-methylazetidin-3-ol;hydrochloride
PubChem CID134691791
Molecular FormulaC4H10ClNO
Molecular Weight123.58 g/mol
Exact Mass123.05
IUPAC Name(2R,3S)-2-methylazetidin-3-ol;hydrochloride
SMILESC[C@H]1NC[C@@H]1O.Cl
InChIInChI=1S/C4H9NO.ClH/c1-3-4(6)2-5-3;/h3-6H,2H2,1H3;1H/t3-,4+;/m1./s1
InChIKeyVGWXJFDIRONLQP-HJXLNUONSA-N
XLogP-0.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.58
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(Azetidin-2-yl)methanol
CID 15251628
(Azetidin-2-yl)methanol hydrochloride
CID 21980084
(2S,3R)-2-Methylazetidin-3-ol hydrochloride
CID 55300647
2-Methylazetidin-3-ol hydrochloride
CID 74889767
1-(Azetidin-2-yl)propan-1-ol
CID 84063989
1-(Azetidin-2-yl)ethan-1-ol hydrochloride
CID 145913197
(S)-Azetidin-2-ylmethanol
CID 10855374
2-Methylazetidin-3-ol
CID 15670683
1-(Azetidin-2-yl)ethan-1-ol
CID 23496510
(2R,3R)-2-(fluoromethyl)azetidin-3-ol
CID 165396259
2-(Fluoromethyl)azetidin-3-ol
CID 171035424
(2S,3R)-2-(fluoromethyl)azetidin-3-ol
CID 171059172

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methylazetidin-3-ol;hydrochloride?
The IUPAC name of (2R,3S)-2-methylazetidin-3-ol;hydrochloride (CID 134691791) is (2R,3S)-2-methylazetidin-3-ol;hydrochloride.
What is the SMILES notation for (2R,3S)-2-methylazetidin-3-ol;hydrochloride?
The canonical SMILES for (2R,3S)-2-methylazetidin-3-ol;hydrochloride is C[C@H]1NC[C@@H]1O.Cl.
What is the InChIKey of (2R,3S)-2-methylazetidin-3-ol;hydrochloride?
The InChIKey is VGWXJFDIRONLQP-HJXLNUONSA-N. The full InChI is InChI=1S/C4H9NO.ClH/c1-3-4(6)2-5-3;/h3-6H,2H2,1H3;1H/t3-,4+;/m1./s1.
What are the key properties of (2R,3S)-2-methylazetidin-3-ol;hydrochloride?
(2R,3S)-2-methylazetidin-3-ol;hydrochloride has a molecular weight of 123.58 g/mol, XLogP of -0.24, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methylazetidin-3-ol;hydrochloride is sourced from PubChem (CID 134691791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).