2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide

C19H16N6O2 — CID 138590337

IUPAC2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2cc3cc(-c4cncn4C)cnc3cn2)ccn1
InChIInChI=1S/C19H16N6O2/c1-25-11-20-10-16(25)14-5-13-6-17(23-9-15(13)22-8-14)24-19(26)12-3-4-21-18(7-12)27-2/h3-11H,1-2H3,(H,23,24,26)
InChIKeyKONJJNMEEONFOS-UHFFFAOYSA-N
MW360.38 g/mol
LogP2.69
Rot. Bonds4

About 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide

2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide (PubChem CID 138590337) has the molecular formula C19H16N6O2 and a molecular weight of 360.38 g/mol. Its IUPAC name is 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
PubChem CID138590337
Molecular FormulaC19H16N6O2
Molecular Weight360.38 g/mol
Exact Mass360.13
IUPAC Name2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2cc3cc(-c4cncn4C)cnc3cn2)ccn1
InChIInChI=1S/C19H16N6O2/c1-25-11-20-10-16(25)14-5-13-6-17(23-9-15(13)22-8-14)24-19(26)12-3-4-21-18(7-12)27-2/h3-11H,1-2H3,(H,23,24,26)
InChIKeyKONJJNMEEONFOS-UHFFFAOYSA-N
XLogP2.69
TPSA94.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide?
The IUPAC name of 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide (CID 138590337) is 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide is COc1cc(C(=O)Nc2cc3cc(-c4cncn4C)cnc3cn2)ccn1.
What is the InChIKey of 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide?
The InChIKey is KONJJNMEEONFOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O2/c1-25-11-20-10-16(25)14-5-13-6-17(23-9-15(13)22-8-14)24-19(26)12-3-4-21-18(7-12)27-2/h3-11H,1-2H3,(H,23,24,26).
What are the key properties of 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide?
2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide has a molecular weight of 360.38 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide is sourced from PubChem (CID 138590337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).