1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine

C16H19N3 — CID 62280507

IUPAC1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C16H19N3/c1-17-11-13-8-9-16(18-12-13)19-10-4-6-14-5-2-3-7-15(14)19/h2-3,5,7-9,12,17H,4,6,10-11H2,1H3
InChIKeyVBRXRLMJANQGRU-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.89
Rot. Bonds3

About 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine

1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine (PubChem CID 62280507) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine
PubChem CID62280507
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C16H19N3/c1-17-11-13-8-9-16(18-12-13)19-10-4-6-14-5-2-3-7-15(14)19/h2-3,5,7-9,12,17H,4,6,10-11H2,1H3
InChIKeyVBRXRLMJANQGRU-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine (CID 62280507) is 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine is CNCc1ccc(N2CCCc3ccccc32)nc1.
What is the InChIKey of 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is VBRXRLMJANQGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-17-11-13-8-9-16(18-12-13)19-10-4-6-14-5-2-3-7-15(14)19/h2-3,5,7-9,12,17H,4,6,10-11H2,1H3.
What are the key properties of 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine?
1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 253.35 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62280507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).