methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate

C19H19N3O3 — CID 166460491

IUPACmethyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate
SMILESCOC(=O)c1cnc2c(C)cc(NCc3ccc(OC)cc3)nc2c1
InChIInChI=1S/C19H19N3O3/c1-12-8-17(20-10-13-4-6-15(24-2)7-5-13)22-16-9-14(19(23)25-3)11-21-18(12)16/h4-9,11H,10H2,1-3H3,(H,20,22)
InChIKeyFZMFIPSEPKSTLF-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.35
Rot. Bonds5

About methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate

methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate (PubChem CID 166460491) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate
PubChem CID166460491
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Namemethyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate
SMILESCOC(=O)c1cnc2c(C)cc(NCc3ccc(OC)cc3)nc2c1
InChIInChI=1S/C19H19N3O3/c1-12-8-17(20-10-13-4-6-15(24-2)7-5-13)22-16-9-14(19(23)25-3)11-21-18(12)16/h4-9,11H,10H2,1-3H3,(H,20,22)
InChIKeyFZMFIPSEPKSTLF-UHFFFAOYSA-N
XLogP3.35
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-bromo-N-[(4-methoxyphenyl)methyl]-4-methyl-1,5-naphthyridin-2-amine
CID 166460553
methyl 4-[[6-[(4-methoxyphenyl)methylamino]pyrimidin-4-yl]amino]benzoate
CID 112860293
dimethyl 8-methylquinoline-3,6-dicarboxylate
CID 164676656
methyl 4-[(4-methoxyanilino)methyl]benzoate;hydrochloride
CID 141308228
2-N-[(4-methoxyphenyl)methyl]-5-methylpyridine-2,4-diamine
CID 83265796
N-[(4-methoxyphenyl)methyl]-4-methyl-6-methylsulfanylquinolin-2-amine
CID 31196612
methyl 6-[(4-chlorophenyl)methylamino]pyridine-3-carboxylate
CID 146669717
methyl 3-[[4-[(4-methoxyphenyl)methylamino]pyrimidin-2-yl]amino]benzoate
CID 112892481
methyl 4-chloro-3-[[6-[(4-methoxyphenyl)methylamino]pyrimidin-4-yl]amino]benzoate
CID 112860294
N-[(4-methoxyphenyl)methyl]-6-[(4-methoxyphenyl)methylamino]-2-methylpyrimidine-4-carboxamide
CID 109370347
2-[(4-methoxyphenyl)methylamino]-N-[(4-methylphenyl)methyl]pyrimidine-5-carboxamide
CID 109256082
methyl 4-chloro-2-[(4-methoxyphenyl)methylamino]-3-methylquinoline-6-carboxylate
CID 156831006

Frequently Asked Questions

What is the IUPAC name of methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate?
The IUPAC name of methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate (CID 166460491) is methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate.
What is the SMILES notation for methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate?
The canonical SMILES for methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate is COC(=O)c1cnc2c(C)cc(NCc3ccc(OC)cc3)nc2c1.
What is the InChIKey of methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate?
The InChIKey is FZMFIPSEPKSTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12-8-17(20-10-13-4-6-15(24-2)7-5-13)22-16-9-14(19(23)25-3)11-21-18(12)16/h4-9,11H,10H2,1-3H3,(H,20,22).
What are the key properties of methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate?
methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate has a molecular weight of 337.38 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[(4-methoxyphenyl)methylamino]-8-methyl-1,5-naphthyridine-3-carboxylate is sourced from PubChem (CID 166460491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).