6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine

C9H14N2O2 — CID 19878068

IUPAC6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine
SMILESC1=COC2=CCNC=C2C1.CNO
InChIInChI=1S/C8H9NO.CH5NO/c1-2-7-6-9-4-3-8(7)10-5-1;1-2-3/h1,3,5-6,9H,2,4H2;2-3H,1H3
InChIKeyCXIXOXVREISFAH-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.89
Rot. Bonds

About 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine

6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine (PubChem CID 19878068) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine.

Molecular Properties

Compound Name6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine
PubChem CID19878068
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine
SMILESC1=COC2=CCNC=C2C1.CNO
InChIInChI=1S/C8H9NO.CH5NO/c1-2-7-6-9-4-3-8(7)10-5-1;1-2-3/h1,3,5-6,9H,2,4H2;2-3H,1H3
InChIKeyCXIXOXVREISFAH-UHFFFAOYSA-N
XLogP0.89
TPSA53.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine?
The IUPAC name of 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine (CID 19878068) is 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine.
What is the SMILES notation for 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine?
The canonical SMILES for 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine is C1=COC2=CCNC=C2C1.CNO.
What is the InChIKey of 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine?
The InChIKey is CXIXOXVREISFAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO.CH5NO/c1-2-7-6-9-4-3-8(7)10-5-1;1-2-3/h1,3,5-6,9H,2,4H2;2-3H,1H3.
What are the key properties of 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine?
6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine has a molecular weight of 182.22 g/mol, XLogP of 0.89, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-4H-pyrano[3,2-c]pyridine;N-methylhydroxylamine is sourced from PubChem (CID 19878068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).