methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate

C16H19N3O4 — CID 166801121

IUPACmethyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate
SMILESCOCc1cc2nccc(C(=O)OC)c2nc1N1CCOCC1
InChIInChI=1S/C16H19N3O4/c1-21-10-11-9-13-14(12(3-4-17-13)16(20)22-2)18-15(11)19-5-7-23-8-6-19/h3-4,9H,5-8,10H2,1-2H3
InChIKeyOJBQLWGBDAYOKQ-UHFFFAOYSA-N
MW317.35 g/mol
LogP1.40
Rot. Bonds4

About methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate

methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate (PubChem CID 166801121) has the molecular formula C16H19N3O4 and a molecular weight of 317.35 g/mol. Its IUPAC name is methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate
PubChem CID166801121
Molecular FormulaC16H19N3O4
Molecular Weight317.35 g/mol
Exact Mass317.14
IUPAC Namemethyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate
SMILESCOCc1cc2nccc(C(=O)OC)c2nc1N1CCOCC1
InChIInChI=1S/C16H19N3O4/c1-21-10-11-9-13-14(12(3-4-17-13)16(20)22-2)18-15(11)19-5-7-23-8-6-19/h3-4,9H,5-8,10H2,1-2H3
InChIKeyOJBQLWGBDAYOKQ-UHFFFAOYSA-N
XLogP1.40
TPSA73.78 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate?
The IUPAC name of methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate (CID 166801121) is methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate.
What is the SMILES notation for methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate?
The canonical SMILES for methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate is COCc1cc2nccc(C(=O)OC)c2nc1N1CCOCC1.
What is the InChIKey of methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate?
The InChIKey is OJBQLWGBDAYOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4/c1-21-10-11-9-13-14(12(3-4-17-13)16(20)22-2)18-15(11)19-5-7-23-8-6-19/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate?
methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate has a molecular weight of 317.35 g/mol, XLogP of 1.40, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-(methoxymethyl)-6-morpholin-4-yl-1,5-naphthyridine-4-carboxylate is sourced from PubChem (CID 166801121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).