2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone

C10H13NO2 — CID 126997749

IUPAC2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(C1=CCCO1)N1CC=CCC1
InChIInChI=1S/C10H13NO2/c12-10(9-5-4-8-13-9)11-6-2-1-3-7-11/h1-2,5H,3-4,6-8H2
InChIKeyLKHFMTGPVFPJFJ-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.08
Rot. Bonds1

About 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone

2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 126997749) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID126997749
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(C1=CCCO1)N1CC=CCC1
InChIInChI=1S/C10H13NO2/c12-10(9-5-4-8-13-9)11-6-2-1-3-7-11/h1-2,5H,3-4,6-8H2
InChIKeyLKHFMTGPVFPJFJ-UHFFFAOYSA-N
XLogP1.08
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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CID 135077053
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CID 130666134
2,3-Dihydrofuran-5-yl-(3-fluoro-3-methylazetidin-1-yl)methanone
CID 131155717
4-[(E)-4-oxopent-2-enyl]morpholin-3-one
CID 118400708
N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide
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2,3-Dihydrofuran-5-yl-(4-methylpiperazin-1-yl)methanone
CID 143306085
2-Methyl-3-(2-oxo-2-pyrrolidin-1-ylethoxy)pyran-4-one
CID 82064551
N,N-diethyl-2-(2-methyl-4-oxopyran-3-yl)oxyacetamide
CID 82064556
2-(2-methyl-4-oxopyran-3-yl)oxy-N,N-dipropylacetamide
CID 82064558
N-butyl-N-methyl-2-(2-methyl-4-oxopyran-3-yl)oxyacetamide
CID 82064560
5-methoxy-2-(pyrrolidin-1-ylcarbonyl)-4H-pyran-4-one
CID 91821217
5-but-3-enoxy-2,3-dihydro-1H-pyridin-6-one
CID 101503646

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone (CID 126997749) is 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone is O=C(C1=CCCO1)N1CC=CCC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is LKHFMTGPVFPJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c12-10(9-5-4-8-13-9)11-6-2-1-3-7-11/h1-2,5H,3-4,6-8H2.
What are the key properties of 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone?
2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 179.22 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl(3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 126997749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).