(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine

C10H11NO — CID 67716823

IUPAC(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine
SMILESC1=C2/C=C\C=C/OCC2=CNC1
InChIInChI=1S/C10H11NO/c1-2-6-12-8-10-7-11-5-4-9(10)3-1/h1-4,6-7,11H,5,8H2/b3-1-,6-2-
InChIKeyWYWMMHWVNJFNLR-SJDXMKNESA-N
MW161.20 g/mol
LogP1.50
Rot. Bonds

About (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine

(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine (PubChem CID 67716823) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine.

Molecular Properties

Compound Name(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine
PubChem CID67716823
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine
SMILESC1=C2/C=C\C=C/OCC2=CNC1
InChIInChI=1S/C10H11NO/c1-2-6-12-8-10-7-11-5-4-9(10)3-1/h1-4,6-7,11H,5,8H2/b3-1-,6-2-
InChIKeyWYWMMHWVNJFNLR-SJDXMKNESA-N
XLogP1.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine?
The IUPAC name of (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine (CID 67716823) is (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine.
What is the SMILES notation for (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine?
The canonical SMILES for (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine is C1=C2/C=C\C=C/OCC2=CNC1.
What is the InChIKey of (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine?
The InChIKey is WYWMMHWVNJFNLR-SJDXMKNESA-N. The full InChI is InChI=1S/C10H11NO/c1-2-6-12-8-10-7-11-5-4-9(10)3-1/h1-4,6-7,11H,5,8H2/b3-1-,6-2-.
What are the key properties of (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine?
(3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine has a molecular weight of 161.20 g/mol, XLogP of 1.50, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-8,9-dihydro-1H-oxocino[3,4-c]pyridine is sourced from PubChem (CID 67716823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).