azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone

C8H14N2O2 — CID 107219278

IUPACazetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone
SMILESCC1(O)CN(C(=O)C2CNC2)C1
InChIInChI=1S/C8H14N2O2/c1-8(12)4-10(5-8)7(11)6-2-9-3-6/h6,9,12H,2-5H2,1H3
InChIKeyKVENPRRXJXZPPA-UHFFFAOYSA-N
MW170.21 g/mol
LogP-1.20
Rot. Bonds1

About azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone

azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone (PubChem CID 107219278) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone.

Molecular Properties

Compound Nameazetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone
PubChem CID107219278
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Nameazetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone
SMILESCC1(O)CN(C(=O)C2CNC2)C1
InChIInChI=1S/C8H14N2O2/c1-8(12)4-10(5-8)7(11)6-2-9-3-6/h6,9,12H,2-5H2,1H3
InChIKeyKVENPRRXJXZPPA-UHFFFAOYSA-N
XLogP-1.20
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-1.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

azetidin-3-yl-(4-hydroxy-3,3-dimethylpyrrolidin-1-yl)methanone
CID 130949562
(3-hydroxy-3-methylazetidin-1-yl)-[3-(methylamino)cyclobutyl]methanone
CID 164651387
azetidin-3-yl-(3-methylazetidin-1-yl)methanone
CID 164653902
azetidin-3-yl-[(4S)-4-(hydroxymethyl)-3,3-dimethylpyrrolidin-1-yl]methanone
CID 129495479
(4-hydroxy-4-methylpiperidin-1-yl)-(5-methylpiperidin-3-yl)methanone
CID 81116250
(3-hydroxy-3-methylazetidin-1-yl)-(4-hydroxypyrrolidin-2-yl)methanone
CID 107219224
azetidin-3-yl-(4,5,5,7,7-pentamethyl-1,4-diazocan-1-yl)methanone
CID 91273926
azetidin-3-yl-(3-methoxy-3-methylpiperidin-1-yl)methanone
CID 107392334
1-(azetidine-3-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318282
(3-ethyl-3-hydroxyazetidin-1-yl)-[(3R)-piperidin-3-yl]methanone
CID 107219702
azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
CID 50951587
6-azaspiro[3.4]octan-6-yl(azetidin-3-yl)methanone
CID 131185783

Frequently Asked Questions

What is the IUPAC name of azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone?
The IUPAC name of azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone (CID 107219278) is azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone.
What is the SMILES notation for azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone?
The canonical SMILES for azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone is CC1(O)CN(C(=O)C2CNC2)C1.
What is the InChIKey of azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone?
The InChIKey is KVENPRRXJXZPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-8(12)4-10(5-8)7(11)6-2-9-3-6/h6,9,12H,2-5H2,1H3.
What are the key properties of azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone?
azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone has a molecular weight of 170.21 g/mol, XLogP of -1.20, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone is sourced from PubChem (CID 107219278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).