1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine

C8H14N2O — CID 163444965

IUPAC1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine
SMILESCNCC1=CC=C(OC)NC1
InChIInChI=1S/C8H14N2O/c1-9-5-7-3-4-8(11-2)10-6-7/h3-4,9-10H,5-6H2,1-2H3
InChIKeyBBSYRDWBPLQBPL-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.22
Rot. Bonds3

About 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine

1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine (PubChem CID 163444965) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine
PubChem CID163444965
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine
SMILESCNCC1=CC=C(OC)NC1
InChIInChI=1S/C8H14N2O/c1-9-5-7-3-4-8(11-2)10-6-7/h3-4,9-10H,5-6H2,1-2H3
InChIKeyBBSYRDWBPLQBPL-UHFFFAOYSA-N
XLogP0.22
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine (CID 163444965) is 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine is CNCC1=CC=C(OC)NC1.
What is the InChIKey of 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine?
The InChIKey is BBSYRDWBPLQBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-9-5-7-3-4-8(11-2)10-6-7/h3-4,9-10H,5-6H2,1-2H3.
What are the key properties of 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine?
1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine has a molecular weight of 154.21 g/mol, XLogP of 0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-1,2-dihydropyridin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 163444965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).