methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate

C18H16N2O2 — CID 177153656

IUPACmethyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate
SMILESCOC(=O)c1nc(C)c2nc(-c3ccccc3)ccc2c1C
InChIInChI=1S/C18H16N2O2/c1-11-14-9-10-15(13-7-5-4-6-8-13)20-17(14)12(2)19-16(11)18(21)22-3/h4-10H,1-3H3
InChIKeyIQZOXWJHRZUGLR-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.70
Rot. Bonds2

About methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate

methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate (PubChem CID 177153656) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate
PubChem CID177153656
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Namemethyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate
SMILESCOC(=O)c1nc(C)c2nc(-c3ccccc3)ccc2c1C
InChIInChI=1S/C18H16N2O2/c1-11-14-9-10-15(13-7-5-4-6-8-13)20-17(14)12(2)19-16(11)18(21)22-3/h4-10H,1-3H3
InChIKeyIQZOXWJHRZUGLR-UHFFFAOYSA-N
XLogP3.70
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 5-hydroxy-8-methyl-2-phenyl-1,7-naphthyridine-6-carboxylate
CID 140866878
methyl 3-methyl-6-phenylpyridine-2-carboxylate
CID 118174962
methyl 5-hydroxy-8-methyl-2-phenoxy-1,7-naphthyridine-6-carboxylate
CID 137285329
methyl 4-hydroxy-7-methyl-2-phenylfuro[2,3-c]pyridine-5-carboxylate
CID 156693356
methyl 6-phenyl-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylate
CID 121251044
methyl 4-[(2-methyl-6-phenylpyridine-3-carbonyl)amino]benzoate
CID 27873719
methyl 5-chloro-2-phenyl-1H-imidazole-4-carboxylate
CID 69111578
methyl 1-methyl-3-phenylisoquinoline-4-carboxylate
CID 138972318
methyl 2-phenyl-5-propan-2-yl-1,3-oxazole-4-carboxylate
CID 58874245
methyl 3-methyl-4-phenyl-5H-pyrido[4,3-b]indole-1-carboxylate
CID 13351963
3-methyl-6-phenylpyridine-2-carboxylic acid
CID 71435914
ethyl 8-methyl-2-phenylquinoline-6-carboxylate
CID 164676553

Frequently Asked Questions

What is the IUPAC name of methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate?
The IUPAC name of methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate (CID 177153656) is methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate.
What is the SMILES notation for methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate?
The canonical SMILES for methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate is COC(=O)c1nc(C)c2nc(-c3ccccc3)ccc2c1C.
What is the InChIKey of methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate?
The InChIKey is IQZOXWJHRZUGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-11-14-9-10-15(13-7-5-4-6-8-13)20-17(14)12(2)19-16(11)18(21)22-3/h4-10H,1-3H3.
What are the key properties of methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate?
methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate has a molecular weight of 292.34 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5,8-dimethyl-2-phenyl-1,7-naphthyridine-6-carboxylate is sourced from PubChem (CID 177153656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).