methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate

C12H14N2O3 — CID 68896178

IUPACmethyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate
SMILESCOC(=O)C1=C(OC)c2ncccc2CN1C
InChIInChI=1S/C12H14N2O3/c1-14-7-8-5-4-6-13-9(8)11(16-2)10(14)12(15)17-3/h4-6H,7H2,1-3H3
InChIKeyMYMBVORFQATVGO-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.01
Rot. Bonds2

About methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate

methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate (PubChem CID 68896178) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate
PubChem CID68896178
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Namemethyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate
SMILESCOC(=O)C1=C(OC)c2ncccc2CN1C
InChIInChI=1S/C12H14N2O3/c1-14-7-8-5-4-6-13-9(8)11(16-2)10(14)12(15)17-3/h4-6H,7H2,1-3H3
InChIKeyMYMBVORFQATVGO-UHFFFAOYSA-N
XLogP1.01
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;6-methyl-5H-pyrrolo[3,4-b]pyridin-7-one
CID 162520423
methyl 2-(4-methylpiperazin-1-yl)pyridine-3-carboxylate
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methyl 2-(5,7-dihydropyrrolo[3,4-b]pyridine-6-carbonyl)benzoate
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methyl 2-[(4-methylpiperazin-1-yl)amino]pyridine-3-carboxylate
CID 115280212
methyl 6,8-dihydro-5H-1,7-naphthyridine-7-carboxylate
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methyl 2-chloro-1-methylpyrrolo[2,3-b]pyridine-3-carboxylate
CID 175615221
4-(bromomethoxy)-2-methyl-N-pyridin-2-yl-1H-isoquinoline-3-carboxamide
CID 59090993
methyl 2-methylpyridine-3-carboxylate
CID 7015327
methyl 2-(2-methoxy-4-pyridinyl)pyridine-3-carboxylate
CID 155342393
cyclohexane;methyl 2-chloropyridine-3-carboxylate
CID 175229380
methanol;methyl 2-methylpyridine-3-carboxylate
CID 174704345
ethane;methyl 3-methylpyridine-2-carboxylate
CID 166536861

Frequently Asked Questions

What is the IUPAC name of methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate?
The IUPAC name of methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate (CID 68896178) is methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate.
What is the SMILES notation for methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate?
The canonical SMILES for methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate is COC(=O)C1=C(OC)c2ncccc2CN1C.
What is the InChIKey of methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate?
The InChIKey is MYMBVORFQATVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-14-7-8-5-4-6-13-9(8)11(16-2)10(14)12(15)17-3/h4-6H,7H2,1-3H3.
What are the key properties of methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate?
methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate has a molecular weight of 234.25 g/mol, XLogP of 1.01, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-methoxy-6-methyl-5H-1,6-naphthyridine-7-carboxylate is sourced from PubChem (CID 68896178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).