azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone

C9H13NO2 — CID 131084146

IUPACazetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone
SMILESO=C(C1=COCCC1)N1CCC1
InChIInChI=1S/C9H13NO2/c11-9(10-4-2-5-10)8-3-1-6-12-7-8/h7H,1-6H2
InChIKeyFNZXQEHMYUNTIN-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.91
Rot. Bonds1

About azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone

azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone (PubChem CID 131084146) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone.

Molecular Properties

Compound Nameazetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone
PubChem CID131084146
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Nameazetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone
SMILESO=C(C1=COCCC1)N1CCC1
InChIInChI=1S/C9H13NO2/c11-9(10-4-2-5-10)8-3-1-6-12-7-8/h7H,1-6H2
InChIKeyFNZXQEHMYUNTIN-UHFFFAOYSA-N
XLogP0.91
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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[4-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]piperazin-1-yl]-(3,4-dihydro-2H-pyran-5-yl)methanone
CID 75463564
[(2R)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-(3,4-dihydro-2H-pyran-5-yl)methanone
CID 129336560
2,3-dihydrofuran-4-yl-(3-fluoroazetidin-1-yl)methanone
CID 130620122
1-(3,4-dihydro-2H-pyran-5-yl)-2-piperazin-1-ylethanone
CID 116559609
3,4-dihydro-2H-pyran-5-yl-(4-phosphanylphenyl)methanone
CID 162283979
(4-aminophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanone
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(2,6-dichlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanone
CID 115798036
3,4-dihydro-2H-pyran-5-yl-[(3S)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129472106
3,4-dihydro-2H-pyran-5-yl-(4-methylthiadiazol-5-yl)methanone
CID 105127375
(5-bromo-3-methyltriazol-4-yl)-(3,4-dihydro-2H-pyran-5-yl)methanone
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Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone?
The IUPAC name of azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone (CID 131084146) is azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone.
What is the SMILES notation for azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone?
The canonical SMILES for azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone is O=C(C1=COCCC1)N1CCC1.
What is the InChIKey of azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone?
The InChIKey is FNZXQEHMYUNTIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c11-9(10-4-2-5-10)8-3-1-6-12-7-8/h7H,1-6H2.
What are the key properties of azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone?
azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone has a molecular weight of 167.21 g/mol, XLogP of 0.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl(3,4-dihydro-2H-pyran-5-yl)methanone is sourced from PubChem (CID 131084146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).