ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate

C16H19N3O3 — CID 10017740

IUPACethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2nc(C)ccc2c1N1CCOCC1
InChIInChI=1S/C16H19N3O3/c1-3-22-16(20)13-10-17-15-12(5-4-11(2)18-15)14(13)19-6-8-21-9-7-19/h4-5,10H,3,6-9H2,1-2H3
InChIKeyDICKJUXXMUBNIM-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.95
Rot. Bonds3

About ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate

ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate (PubChem CID 10017740) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate
PubChem CID10017740
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Nameethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2nc(C)ccc2c1N1CCOCC1
InChIInChI=1S/C16H19N3O3/c1-3-22-16(20)13-10-17-15-12(5-4-11(2)18-15)14(13)19-6-8-21-9-7-19/h4-5,10H,3,6-9H2,1-2H3
InChIKeyDICKJUXXMUBNIM-UHFFFAOYSA-N
XLogP1.95
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Ethyl 5-amino-6,7,8,9-tetrahydro-2-methyl-4-phenylbenzo(1,8)naphthyridine-3-carboxylate
CID 6918662
Ethyl 5-Amino-2-methyl-6,7,8,9-tetrahydrobenzo(b)(1,8)naphthyridine-3-carboxylate
CID 46861819
Methyl 5-Amino-2-methyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate
CID 46867254
methyl 5-amino-2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b][1,8]naphthyridine-3-carboxylate
CID 46867255
Methyl 5-amino-2-methyl-6,7,8,9,10,11-hexahydrocycloocta[b][1,8]naphthyridine-3-carboxylate
CID 46867256
ethyl 5-amino-2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b][1,8]naphthyridine-3-carboxylate
CID 46867383
Ethyl 5-amino-2-methyl-6,7,8,9,10,11-hexahydrocycloocta[b][1,8]naphthyridine-3-carboxylate
CID 46867384
2-Methyl-1,8-naphthyridine-3-carboxylic acid
CID 2736908
Ethyl 4-((2-(pyridin-3-yl)quinazolin-4-yl)amino)benzoate
CID 1186128
4-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-3-carboxylic acid phenyl ester
CID 11358905
(2,4-Diamino-5-methylpyridino[2,3-d]pyrimidin-6-yl)methyl benzoate
CID 487404
Ethyl 2,4-diphenyl-5-pyrimidinecarboxylate
CID 1487223

Frequently Asked Questions

What is the IUPAC name of ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate?
The IUPAC name of ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate (CID 10017740) is ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate.
What is the SMILES notation for ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate?
The canonical SMILES for ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate is CCOC(=O)c1cnc2nc(C)ccc2c1N1CCOCC1.
What is the InChIKey of ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate?
The InChIKey is DICKJUXXMUBNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-3-22-16(20)13-10-17-15-12(5-4-11(2)18-15)14(13)19-6-8-21-9-7-19/h4-5,10H,3,6-9H2,1-2H3.
What are the key properties of ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate?
ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate has a molecular weight of 301.35 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-methyl-4-morpholin-4-yl-1,8-naphthyridine-3-carboxylate is sourced from PubChem (CID 10017740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).