5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride

C9H13ClN2O — CID 146585921

IUPAC5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride
SMILESCOc1nccc2c1CCNC2.Cl
InChIInChI=1S/C9H12N2O.ClH/c1-12-9-8-3-4-10-6-7(8)2-5-11-9;/h2,5,10H,3-4,6H2,1H3;1H
InChIKeyNCNOHKIKRZKFSV-UHFFFAOYSA-N
MW200.67 g/mol
LogP1.16
Rot. Bonds1

About 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride

5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride (PubChem CID 146585921) has the molecular formula C9H13ClN2O and a molecular weight of 200.67 g/mol. Its IUPAC name is 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride.

Molecular Properties

Compound Name5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride
PubChem CID146585921
Molecular FormulaC9H13ClN2O
Molecular Weight200.67 g/mol
Exact Mass200.07
IUPAC Name5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride
SMILESCOc1nccc2c1CCNC2.Cl
InChIInChI=1S/C9H12N2O.ClH/c1-12-9-8-3-4-10-6-7(8)2-5-11-9;/h2,5,10H,3-4,6H2,1H3;1H
InChIKeyNCNOHKIKRZKFSV-UHFFFAOYSA-N
XLogP1.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.67
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-4-(1,2,3,4-tetrahydroisoquinolin-5-yl)pyridine-3-carbonitrile
CID 56868045
5,6,7,8-tetrahydro-2,6-naphthyridin-1-yl 2,2,2-trifluoroacetate
CID 91007291
5-chloro-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 53435831
5,6,7,8-tetrahydro-2,6-naphthyridine-1-carboxylic acid;dihydrochloride
CID 146155251
6-ethoxy-5-methoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
CID 160634725
5-methoxy-6-methyl-1,2,3,4-tetrahydroisoquinoline
CID 83874749
5-methoxy-1,2,3,4-tetrahydroisoquinolin-6-amine
CID 84656591
N-[(2,4-dimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-2,6-naphthyridin-1-amine
CID 162376872
4-methoxy-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 84716986
6-methoxy-1,2,3,4-tetrahydroisoquinolin-5-ol
CID 83875098
7-methoxy-1,3-dihydropyrrolo[2,3-c]pyridin-2-one
CID 66570660
6-(2,2-difluoroethoxy)-5-methoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
CID 162309445

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride?
The IUPAC name of 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride (CID 146585921) is 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride.
What is the SMILES notation for 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride?
The canonical SMILES for 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride is COc1nccc2c1CCNC2.Cl.
What is the InChIKey of 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride?
The InChIKey is NCNOHKIKRZKFSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O.ClH/c1-12-9-8-3-4-10-6-7(8)2-5-11-9;/h2,5,10H,3-4,6H2,1H3;1H.
What are the key properties of 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride?
5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride has a molecular weight of 200.67 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1,2,3,4-tetrahydro-2,6-naphthyridine;hydrochloride is sourced from PubChem (CID 146585921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).