1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one

C17H27NO2 — CID 19600095

IUPAC1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one
SMILESCCCCCCCCCC(=O)N1CCc2ccoc2C1
InChIInChI=1S/C17H27NO2/c1-2-3-4-5-6-7-8-9-17(19)18-12-10-15-11-13-20-16(15)14-18/h11,13H,2-10,12,14H2,1H3
InChIKeyWYCMDTNJCBKRDF-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.30
Rot. Bonds8

About 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one

1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one (PubChem CID 19600095) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one.

Molecular Properties

Compound Name1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one
PubChem CID19600095
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one
SMILESCCCCCCCCCC(=O)N1CCc2ccoc2C1
InChIInChI=1S/C17H27NO2/c1-2-3-4-5-6-7-8-9-17(19)18-12-10-15-11-13-20-16(15)14-18/h11,13H,2-10,12,14H2,1H3
InChIKeyWYCMDTNJCBKRDF-UHFFFAOYSA-N
XLogP4.30
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-phenyl-1-(4,5,7,8-tetrahydrofuro[2,3-d]azepin-6-yl)hexan-1-one
CID 19600053
butyl 4,5,6,8-tetrahydrofuro[2,3-c]azepine-7-carboxylate
CID 67696630
1-(4-octadecanoylpiperazin-1-yl)octadecan-1-one
CID 550164
1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-2-naphthalen-2-yloxyethanone
CID 19600229
1-(4-methylpiperazin-1-yl)heptadecan-1-one
CID 10043612
1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)hexan-1-one
CID 36804449
1-[18,39-di(dodecanoyl)-4,26,31-trioxa-1,12,15,18,39-pentazapentacyclo[13.13.13.05,10.020,25.032,37]hentetraconta-5,7,9,20,22,24,32,34,36-nonaen-12-yl]dodecan-1-one
CID 101051038
1-[4-(furan-3-carbonyl)piperazin-1-yl]octan-1-one
CID 134022004
ethyl 6-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxohexanoate
CID 13101561
1-pyrrolidin-1-ylheptadecan-1-one
CID 574649
1-(2-amino-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)hexan-1-one
CID 68679098
1-[7-(1-hydroxypentyl)-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one
CID 82175706

Frequently Asked Questions

What is the IUPAC name of 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one?
The IUPAC name of 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one (CID 19600095) is 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one.
What is the SMILES notation for 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one?
The canonical SMILES for 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one is CCCCCCCCCC(=O)N1CCc2ccoc2C1.
What is the InChIKey of 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one?
The InChIKey is WYCMDTNJCBKRDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-2-3-4-5-6-7-8-9-17(19)18-12-10-15-11-13-20-16(15)14-18/h11,13H,2-10,12,14H2,1H3.
What are the key properties of 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one?
1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one has a molecular weight of 277.41 g/mol, XLogP of 4.30, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)decan-1-one is sourced from PubChem (CID 19600095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).