2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone

C11H17NO2 — CID 102652463

IUPAC2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCNCC1
InChIInChI=1S/C11H17NO2/c1-11(4-6-12-7-5-11)10(13)9-3-2-8-14-9/h3,12H,2,4-8H2,1H3
InChIKeyLFLUDVXRFDFIQN-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.25
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone

2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone (PubChem CID 102652463) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone
PubChem CID102652463
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCNCC1
InChIInChI=1S/C11H17NO2/c1-11(4-6-12-7-5-11)10(13)9-3-2-8-14-9/h3,12H,2,4-8H2,1H3
InChIKeyLFLUDVXRFDFIQN-UHFFFAOYSA-N
XLogP1.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-pyran-6-yl(piperidin-4-yl)methanone
CID 102648266
1-(3,4-dihydro-2H-pyran-6-yl)-4-(methylamino)butan-1-one
CID 102648296
1-(3,4-dihydro-2H-pyran-6-yl)-4-(propan-2-ylamino)butan-1-one
CID 102648305
3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone
CID 102648340
3,4-dihydro-2H-pyran-6-yl-(4-ethylpiperidin-4-yl)methanone
CID 102648342
3,4-dihydro-2H-pyran-6-yl(pyrrolidin-3-yl)methanone
CID 102648343
3,4-dihydro-2H-pyran-6-yl-(4-propylpiperidin-4-yl)methanone
CID 102648346
3,4-dihydro-2H-pyran-6-yl-(3-methylpyrrolidin-3-yl)methanone
CID 102648349
3,4-dihydro-2H-pyran-6-yl-(3-ethylpyrrolidin-3-yl)methanone
CID 102648350
3,4-dihydro-2H-pyran-6-yl-(3-propylpyrrolidin-3-yl)methanone
CID 102648351
3,4-dihydro-2H-pyran-6-yl-(4-methylpyrrolidin-3-yl)methanone
CID 102648358
3,4-dihydro-2H-pyran-6-yl-(2-methylpyrrolidin-3-yl)methanone
CID 102648426

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone (CID 102652463) is 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone is CC1(C(=O)C2=CCCO2)CCNCC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone?
The InChIKey is LFLUDVXRFDFIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-11(4-6-12-7-5-11)10(13)9-3-2-8-14-9/h3,12H,2,4-8H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone?
2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone has a molecular weight of 195.26 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 102652463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).