1,2,3,5-tetrahydrofuro[3,4-b]pyridine

C7H9NO — CID 123572087

IUPAC1,2,3,5-tetrahydrofuro[3,4-b]pyridine
SMILESC1=C2COC=C2NCC1
InChIInChI=1S/C7H9NO/c1-2-6-4-9-5-7(6)8-3-1/h2,5,8H,1,3-4H2
InChIKeyHXXJBJVNLSYWHA-UHFFFAOYSA-N
MW123.15 g/mol
LogP0.78
Rot. Bonds

About 1,2,3,5-tetrahydrofuro[3,4-b]pyridine

1,2,3,5-tetrahydrofuro[3,4-b]pyridine (PubChem CID 123572087) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 1,2,3,5-tetrahydrofuro[3,4-b]pyridine.

Molecular Properties

Compound Name1,2,3,5-tetrahydrofuro[3,4-b]pyridine
PubChem CID123572087
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name1,2,3,5-tetrahydrofuro[3,4-b]pyridine
SMILESC1=C2COC=C2NCC1
InChIInChI=1S/C7H9NO/c1-2-6-4-9-5-7(6)8-3-1/h2,5,8H,1,3-4H2
InChIKeyHXXJBJVNLSYWHA-UHFFFAOYSA-N
XLogP0.78
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Dihydro-5h-pyrano[4,3-b]pyridine
CID 19418420
1,2,3,6-Tetrahydropyrano[4,3-b]pyrrole
CID 133083387
2,3-Dihydropyrano[3,2-e]indole
CID 54302224
2-Methoxy-3,4,6-trimethyl-1,2-dihydropyridine
CID 142339691
Ethane;2,3,4,5-tetrahydrofuro[3,2-b]pyridine
CID 143737718
1,2,3,4-Tetrahydropyrano[4,3-b]pyrrole
CID 152533619
2,6-dihydro-1H-pyrano[3,4-b]pyridine
CID 172211651
2,3,4,5-Tetrahydrofuro[3,2-b]pyridine
CID 143737719

Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetrahydrofuro[3,4-b]pyridine?
The IUPAC name of 1,2,3,5-tetrahydrofuro[3,4-b]pyridine (CID 123572087) is 1,2,3,5-tetrahydrofuro[3,4-b]pyridine.
What is the SMILES notation for 1,2,3,5-tetrahydrofuro[3,4-b]pyridine?
The canonical SMILES for 1,2,3,5-tetrahydrofuro[3,4-b]pyridine is C1=C2COC=C2NCC1.
What is the InChIKey of 1,2,3,5-tetrahydrofuro[3,4-b]pyridine?
The InChIKey is HXXJBJVNLSYWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-2-6-4-9-5-7(6)8-3-1/h2,5,8H,1,3-4H2.
What are the key properties of 1,2,3,5-tetrahydrofuro[3,4-b]pyridine?
1,2,3,5-tetrahydrofuro[3,4-b]pyridine has a molecular weight of 123.15 g/mol, XLogP of 0.78, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetrahydrofuro[3,4-b]pyridine is sourced from PubChem (CID 123572087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).