spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]

C14H19NO — CID 165476138

IUPACspiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]
SMILESc1cc2c(o1)CCNC21CC2CCC1CC2
InChIInChI=1S/C14H19NO/c1-3-11-4-2-10(1)9-14(11)12-6-8-16-13(12)5-7-15-14/h6,8,10-11,15H,1-5,7,9H2
InChIKeyNHHZOHVVUGKYKS-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.83
Rot. Bonds

About spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]

spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] (PubChem CID 165476138) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane].

Molecular Properties

Compound Namespiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]
PubChem CID165476138
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Namespiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]
SMILESc1cc2c(o1)CCNC21CC2CCC1CC2
InChIInChI=1S/C14H19NO/c1-3-11-4-2-10(1)9-14(11)12-6-8-16-13(12)5-7-15-14/h6,8,10-11,15H,1-5,7,9H2
InChIKeyNHHZOHVVUGKYKS-UHFFFAOYSA-N
XLogP2.83
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] with MolForge

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Related Compounds

1',1'-dimethylspiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,3'-cyclopentane]
CID 165466327
4-(2-aminoethyl)-5-methyl-6,7-dihydro-5H-1-benzofuran-4-ol
CID 112715380
tert-butyl N-[[4-(methoxymethyl)-6,7-dihydro-5H-furo[3,2-c]pyridin-4-yl]methyl]carbamate
CID 165477755
5,5-dimethylspiro[6,7-dihydro-1-benzofuran-4,3'-pyrrolidine]
CID 112715807
methyl 4-amino-5-methyl-6,7-dihydro-5H-1-benzofuran-4-carboxylate
CID 112716289
4-(1-methylsulfanylcyclopropyl)-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
CID 165469842
4-methyl-5,6,7,8-tetrahydro-4H-furo[2,3-d]azepine
CID 82417304
N-[(4-hydroxy-6,7-dihydro-5H-1-benzofuran-4-yl)methyl]cyclopentanecarboxamide
CID 134160415
7-cyclobutyl-7-ethyl-5,6-dihydro-4H-furo[2,3-c]pyridine
CID 165477631
4-(2,6-dimethoxyphenyl)-6,7-dihydro-5H-1-benzofuran-4-ol
CID 116809816
4-(3,5-dimethoxyphenyl)-6,7-dihydro-5H-1-benzofuran-4-ol
CID 115467084
2-(furan-2-yl)bicyclo[2.2.1]heptan-2-ol
CID 78066699

Frequently Asked Questions

What is the IUPAC name of spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]?
The IUPAC name of spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] (CID 165476138) is spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane].
What is the SMILES notation for spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]?
The canonical SMILES for spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] is c1cc2c(o1)CCNC21CC2CCC1CC2.
What is the InChIKey of spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]?
The InChIKey is NHHZOHVVUGKYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-11-4-2-10(1)9-14(11)12-6-8-16-13(12)5-7-15-14/h6,8,10-11,15H,1-5,7,9H2.
What are the key properties of spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane]?
spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] has a molecular weight of 217.31 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[6,7-dihydro-5H-furo[3,2-c]pyridine-4,2'-bicyclo[2.2.2]octane] is sourced from PubChem (CID 165476138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).