(2-ethylazetidin-3-yl)methanol

C6H13NO — CID 105427056

IUPAC(2-ethylazetidin-3-yl)methanol
SMILESCCC1NCC1CO
InChIInChI=1S/C6H13NO/c1-2-6-5(4-8)3-7-6/h5-8H,2-4H2,1H3
InChIKeyKKNHFLIOTCOJDI-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.02
Rot. Bonds2

About (2-ethylazetidin-3-yl)methanol

(2-ethylazetidin-3-yl)methanol (PubChem CID 105427056) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (2-ethylazetidin-3-yl)methanol.

Molecular Properties

Compound Name(2-ethylazetidin-3-yl)methanol
PubChem CID105427056
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(2-ethylazetidin-3-yl)methanol
SMILESCCC1NCC1CO
InChIInChI=1S/C6H13NO/c1-2-6-5(4-8)3-7-6/h5-8H,2-4H2,1H3
InChIKeyKKNHFLIOTCOJDI-UHFFFAOYSA-N
XLogP-0.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol
CID 124705557
[2-(2-methylpropyl)azetidin-3-yl]methanol
CID 105428528
(3R,4S,5R,6S)-6-ethyl-5-(hydroxymethyl)piperidine-3,4-diol
CID 154572787
(6-ethyl-5-methylpiperidin-3-yl)methanol
CID 83914164
[(1R,2R)-2-ethylcyclohexyl]methanol
CID 58154483
[(2S,3S)-3-prop-2-enylazetidin-2-yl]methanol
CID 131014550
2-(3-ethyl-5-methylpiperidin-2-yl)ethanol
CID 123627607
2,3-diethylpyrrolidine;molecular hydrogen
CID 178039705
(2S,3S,4S)-2-ethyl-4-iodo-3-methylpyrrolidine
CID 134386968
(2S,3S)-2,3-diethylpiperidine
CID 89278402
[(1R,5S)-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]methanol
CID 59551331
[(1R,2S,5R)-3-azabicyclo[3.1.0]hexan-2-yl]methanol;hydrochloride
CID 126969951

Frequently Asked Questions

What is the IUPAC name of (2-ethylazetidin-3-yl)methanol?
The IUPAC name of (2-ethylazetidin-3-yl)methanol (CID 105427056) is (2-ethylazetidin-3-yl)methanol.
What is the SMILES notation for (2-ethylazetidin-3-yl)methanol?
The canonical SMILES for (2-ethylazetidin-3-yl)methanol is CCC1NCC1CO.
What is the InChIKey of (2-ethylazetidin-3-yl)methanol?
The InChIKey is KKNHFLIOTCOJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-2-6-5(4-8)3-7-6/h5-8H,2-4H2,1H3.
What are the key properties of (2-ethylazetidin-3-yl)methanol?
(2-ethylazetidin-3-yl)methanol has a molecular weight of 115.18 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylazetidin-3-yl)methanol is sourced from PubChem (CID 105427056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).