3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine

C22H21N5O4 — CID 175969012

IUPAC3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine
SMILESCOc1cnc2c(Cc3cnc(OCc4ccc(OC)nn4)c(OC)c3)ccnc2c1
InChIInChI=1S/C22H21N5O4/c1-28-17-10-18-21(24-12-17)15(6-7-23-18)8-14-9-19(29-2)22(25-11-14)31-13-16-4-5-20(30-3)27-26-16/h4-7,9-12H,8,13H2,1-3H3
InChIKeyIOWIFLAEEXVURF-UHFFFAOYSA-N
MW419.44 g/mol
LogP3.01
Rot. Bonds8

About 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine

3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine (PubChem CID 175969012) has the molecular formula C22H21N5O4 and a molecular weight of 419.44 g/mol. Its IUPAC name is 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine.

Molecular Properties

Compound Name3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine
PubChem CID175969012
Molecular FormulaC22H21N5O4
Molecular Weight419.44 g/mol
Exact Mass419.16
IUPAC Name3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine
SMILESCOc1cnc2c(Cc3cnc(OCc4ccc(OC)nn4)c(OC)c3)ccnc2c1
InChIInChI=1S/C22H21N5O4/c1-28-17-10-18-21(24-12-17)15(6-7-23-18)8-14-9-19(29-2)22(25-11-14)31-13-16-4-5-20(30-3)27-26-16/h4-7,9-12H,8,13H2,1-3H3
InChIKeyIOWIFLAEEXVURF-UHFFFAOYSA-N
XLogP3.01
TPSA101.37 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.44
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine with MolForge

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Related Compounds

8-[[5-methoxy-6-[(5-methoxy-2-pyridinyl)methoxy]-3-pyridinyl]methyl]pyrido[3,2-d]pyrimidine
CID 175969011
5-[8-[[5-methoxy-6-[(5-methoxy-2-pyridinyl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridin-3-yl]-2-methyl-1,3-thiazole
CID 176887929
3-methoxy-8-methyl-1,5-naphthyridine
CID 67962476
3-methoxy-6-[[3-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]oxymethyl]pyridazine
CID 175968994
4-methoxy-3-[(5-methoxy-2-pyridinyl)methyl]phenol
CID 14333130
3-methoxy-6-(methoxymethyl)pyridazine
CID 117104950
6-[(5-methoxy-2-pyridinyl)methoxy]-2-(2-methylpyrimidin-4-yl)-[1,3]oxazolo[5,4-b]pyridine
CID 166038673
8-[(4-methoxyphenyl)methyl]-[1,3]dioxolo[4,5-g]quinoline
CID 91664973
[5-methoxy-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methanamine
CID 67509821
[3-[(3-methoxyphenyl)methoxy]pyridazin-4-yl]methanamine
CID 80508057
4,7-dimethoxyquinoline
CID 20743716
1-[6-(3-methoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
CID 62297460

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine?
The IUPAC name of 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine (CID 175969012) is 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine.
What is the SMILES notation for 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine?
The canonical SMILES for 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine is COc1cnc2c(Cc3cnc(OCc4ccc(OC)nn4)c(OC)c3)ccnc2c1.
What is the InChIKey of 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine?
The InChIKey is IOWIFLAEEXVURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O4/c1-28-17-10-18-21(24-12-17)15(6-7-23-18)8-14-9-19(29-2)22(25-11-14)31-13-16-4-5-20(30-3)27-26-16/h4-7,9-12H,8,13H2,1-3H3.
What are the key properties of 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine?
3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine has a molecular weight of 419.44 g/mol, XLogP of 3.01, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-8-[[5-methoxy-6-[(6-methoxypyridazin-3-yl)methoxy]-3-pyridinyl]methyl]-1,5-naphthyridine is sourced from PubChem (CID 175969012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).