2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate

C16H19N3O5 — CID 170122877

IUPAC2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate
SMILESCOCCOC(=O)c1ncc2nc(N3CCOCC3)ccc2c1O
InChIInChI=1S/C16H19N3O5/c1-22-8-9-24-16(21)14-15(20)11-2-3-13(18-12(11)10-17-14)19-4-6-23-7-5-19/h2-3,10,20H,4-9H2,1H3
InChIKeyYQFAKCJUWCPCBE-UHFFFAOYSA-N
MW333.34 g/mol
LogP0.98
Rot. Bonds5

About 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate

2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate (PubChem CID 170122877) has the molecular formula C16H19N3O5 and a molecular weight of 333.34 g/mol. Its IUPAC name is 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate.

Molecular Properties

Compound Name2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate
PubChem CID170122877
Molecular FormulaC16H19N3O5
Molecular Weight333.34 g/mol
Exact Mass333.13
IUPAC Name2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate
SMILESCOCCOC(=O)c1ncc2nc(N3CCOCC3)ccc2c1O
InChIInChI=1S/C16H19N3O5/c1-22-8-9-24-16(21)14-15(20)11-2-3-13(18-12(11)10-17-14)19-4-6-23-7-5-19/h2-3,10,20H,4-9H2,1H3
InChIKeyYQFAKCJUWCPCBE-UHFFFAOYSA-N
XLogP0.98
TPSA94.01 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.34
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

methyl 3-chloro-6-morpholin-4-ylpyridine-2-carboxylate
CID 134159276
ethyl 6-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyridine-3-carboxylate
CID 155513244
methyl 4-morpholin-4-ylpyrimidine-2-carboxylate
CID 150936080
2-methyl-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 67287742
3-(5-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)propanoic acid
CID 69225392
2-ethoxyethyl 2,4-dimorpholin-4-ylpyrimidine-5-carboxylate
CID 154109144
1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 34669155
ethyl 4-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]benzoate
CID 158655887
4-(3-iodo-2H-pyrazolo[3,4-b]pyridin-6-yl)morpholine;methyl 6-morpholin-4-yl-2H-pyrazolo[3,4-b]pyridine-3-carboxylate
CID 162116947
ethyl 4-(methylamino)-2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidine-5-carboxylate
CID 159140970
methyl 6-morpholin-4-ylpyridazine-3-carboxylate
CID 121206139
methyl 3-azido-6-bromo-2-(6-morpholin-4-yl-3-pyridinyl)pyridine-4-carboxylate
CID 86663023

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate?
The IUPAC name of 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate (CID 170122877) is 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate.
What is the SMILES notation for 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate?
The canonical SMILES for 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate is COCCOC(=O)c1ncc2nc(N3CCOCC3)ccc2c1O.
What is the InChIKey of 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate?
The InChIKey is YQFAKCJUWCPCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O5/c1-22-8-9-24-16(21)14-15(20)11-2-3-13(18-12(11)10-17-14)19-4-6-23-7-5-19/h2-3,10,20H,4-9H2,1H3.
What are the key properties of 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate?
2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate has a molecular weight of 333.34 g/mol, XLogP of 0.98, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl 5-hydroxy-2-morpholin-4-yl-1,7-naphthyridine-6-carboxylate is sourced from PubChem (CID 170122877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).