1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine

C14H20N2O2 — CID 102647849

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
SMILESCNC(Cc1ccc(OC)nc1)C1=CCCCO1
InChIInChI=1S/C14H20N2O2/c1-15-12(13-5-3-4-8-18-13)9-11-6-7-14(17-2)16-10-11/h5-7,10,12,15H,3-4,8-9H2,1-2H3
InChIKeyCNKKPPZOPNIEQS-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.91
Rot. Bonds5

About 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine

1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine (PubChem CID 102647849) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
PubChem CID102647849
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
SMILESCNC(Cc1ccc(OC)nc1)C1=CCCCO1
InChIInChI=1S/C14H20N2O2/c1-15-12(13-5-3-4-8-18-13)9-11-6-7-14(17-2)16-10-11/h5-7,10,12,15H,3-4,8-9H2,1-2H3
InChIKeyCNKKPPZOPNIEQS-UHFFFAOYSA-N
XLogP1.91
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 102650080
1-(cyclohexen-1-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
CID 106653948
[1-(cyclohexen-1-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 106649305
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
CID 102647204
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
CID 102649497
1-(2,3-dihydrofuran-5-yl)-N-methyl-2-naphthalen-2-ylethanamine
CID 102652890
1-(4-bromo-3-chloro-2-fluorophenyl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
CID 106762794
[1-(6-methoxy-3-pyridinyl)-3-methylbutan-2-yl]hydrazine
CID 105250512
N-[1-(3,4-dihydro-2H-pyran-6-yl)-2-(3,4-dimethylphenyl)ethyl]propan-1-amine
CID 102647380
[2-(6-methoxy-3-pyridinyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105250486
[1-(2,4-dimethylphenyl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250487
[1-cyclobutyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250610

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine (CID 102647849) is 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine is CNC(Cc1ccc(OC)nc1)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine?
The InChIKey is CNKKPPZOPNIEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-15-12(13-5-3-4-8-18-13)9-11-6-7-14(17-2)16-10-11/h5-7,10,12,15H,3-4,8-9H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine?
1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine has a molecular weight of 248.33 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine is sourced from PubChem (CID 102647849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).