N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine

C19H26N4O — CID 97463743

IUPACN,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine
SMILESCN(C)CCOCc1cncc2c1CCN(Cc1ccccn1)C2
InChIInChI=1S/C19H26N4O/c1-22(2)9-10-24-15-17-12-20-11-16-13-23(8-6-19(16)17)14-18-5-3-4-7-21-18/h3-5,7,11-12H,6,8-10,13-15H2,1-2H3
InChIKeySPLKKNVGZLHQCA-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.11
Rot. Bonds7

About N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine

N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine (PubChem CID 97463743) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine
PubChem CID97463743
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine
SMILESCN(C)CCOCc1cncc2c1CCN(Cc1ccccn1)C2
InChIInChI=1S/C19H26N4O/c1-22(2)9-10-24-15-17-12-20-11-16-13-23(8-6-19(16)17)14-18-5-3-4-7-21-18/h3-5,7,11-12H,6,8-10,13-15H2,1-2H3
InChIKeySPLKKNVGZLHQCA-UHFFFAOYSA-N
XLogP2.11
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine with MolForge

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Related Compounds

N-{[6-(Methoxymethyl)pyridin-2-yl]methyl}-N-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
CID 53326307
3-Methoxymethyl-5-pyridin-2-ylethynyl-pyridine
CID 44345143
1'-Benzylspiro[3,4-dihydropyrano[3,4-c]pyridine-1,4'-piperidine]
CID 102143524
5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 5-((1-methylpiperid-2-yl)methoxy)-
CID 29578
2-Morpholino-1,1-di(pyridin-3-yl)propan-1-ol
CID 11688027
5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 5-(2-(dimethylamino)ethoxy)-
CID 28822
5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 10,11-dihydro-5-((1-methylpiperid-2-yl)methoxy)-
CID 29046
Piperazine, 1-(2-methoxy-2-(3-pyridyl)ethyl)-4-phenyl-
CID 3045000
Piperazine, 1-(2-ethoxy-2-(3-pyridyl)ethyl)-4-phenyl-
CID 3045001
Morpholine, 4-(2-(alpha-methyl-alpha-(2-pyridyl)benzyloxy)ethyl)-, hydrochloride
CID 3057370
Piperazine, 1-(2-methoxy-2-(3-pyridyl)ethyl)-4-(o-tolyl)-
CID 3059791
Piperazine, 1-(2-ethoxy-2-(3-pyridyl)ethyl)-4-(o-tolyl)-
CID 3059792

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine?
The IUPAC name of N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine (CID 97463743) is N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine is CN(C)CCOCc1cncc2c1CCN(Cc1ccccn1)C2.
What is the InChIKey of N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine?
The InChIKey is SPLKKNVGZLHQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-22(2)9-10-24-15-17-12-20-11-16-13-23(8-6-19(16)17)14-18-5-3-4-7-21-18/h3-5,7,11-12H,6,8-10,13-15H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine?
N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine has a molecular weight of 326.44 g/mol, XLogP of 2.11, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine is sourced from PubChem (CID 97463743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).