6-methoxy-2,3-dihydrochromen-4-imine

C10H11NO2 — CID 70307921

IUPAC6-methoxy-2,3-dihydrochromen-4-imine
SMILES[H]/N=C1\CCOc2ccc(OC)cc21
InChIInChI=1S/C10H11NO2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-3,6,11H,4-5H2,1H3/b11-9+
InChIKeyIPYXSOUOWUNOKM-PKNBQFBNSA-N
MW177.20 g/mol
LogP1.85
Rot. Bonds1

About 6-methoxy-2,3-dihydrochromen-4-imine

6-methoxy-2,3-dihydrochromen-4-imine (PubChem CID 70307921) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 6-methoxy-2,3-dihydrochromen-4-imine.

Molecular Properties

Compound Name6-methoxy-2,3-dihydrochromen-4-imine
PubChem CID70307921
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name6-methoxy-2,3-dihydrochromen-4-imine
SMILES[H]/N=C1\CCOc2ccc(OC)cc21
InChIInChI=1S/C10H11NO2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-3,6,11H,4-5H2,1H3/b11-9+
InChIKeyIPYXSOUOWUNOKM-PKNBQFBNSA-N
XLogP1.85
TPSA42.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,3-dihydrochromen-4-imine?
The IUPAC name of 6-methoxy-2,3-dihydrochromen-4-imine (CID 70307921) is 6-methoxy-2,3-dihydrochromen-4-imine.
What is the SMILES notation for 6-methoxy-2,3-dihydrochromen-4-imine?
The canonical SMILES for 6-methoxy-2,3-dihydrochromen-4-imine is [H]/N=C1\CCOc2ccc(OC)cc21.
What is the InChIKey of 6-methoxy-2,3-dihydrochromen-4-imine?
The InChIKey is IPYXSOUOWUNOKM-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H11NO2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-3,6,11H,4-5H2,1H3/b11-9+.
What are the key properties of 6-methoxy-2,3-dihydrochromen-4-imine?
6-methoxy-2,3-dihydrochromen-4-imine has a molecular weight of 177.20 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,3-dihydrochromen-4-imine is sourced from PubChem (CID 70307921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).