2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide

C24H19N5O2 — CID 71241914

IUPAC2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
SMILESCn1ncc2ccc(-c3cc(OCc4ncccc4C(N)=O)c4cccnc4c3)cc21
InChIInChI=1S/C24H19N5O2/c1-29-22-11-15(6-7-16(22)13-28-29)17-10-20-18(4-2-8-26-20)23(12-17)31-14-21-19(24(25)30)5-3-9-27-21/h2-13H,14H2,1H3,(H2,25,30)
InChIKeyBYRWTSYZTVPYKJ-UHFFFAOYSA-N
MW409.45 g/mol
LogP3.86
Rot. Bonds5

About 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide

2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide (PubChem CID 71241914) has the molecular formula C24H19N5O2 and a molecular weight of 409.45 g/mol. Its IUPAC name is 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
PubChem CID71241914
Molecular FormulaC24H19N5O2
Molecular Weight409.45 g/mol
Exact Mass409.15
IUPAC Name2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
SMILESCn1ncc2ccc(-c3cc(OCc4ncccc4C(N)=O)c4cccnc4c3)cc21
InChIInChI=1S/C24H19N5O2/c1-29-22-11-15(6-7-16(22)13-28-29)17-10-20-18(4-2-8-26-20)23(12-17)31-14-21-19(24(25)30)5-3-9-27-21/h2-13H,14H2,1H3,(H2,25,30)
InChIKeyBYRWTSYZTVPYKJ-UHFFFAOYSA-N
XLogP3.86
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.45
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The IUPAC name of 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide (CID 71241914) is 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide is Cn1ncc2ccc(-c3cc(OCc4ncccc4C(N)=O)c4cccnc4c3)cc21.
What is the InChIKey of 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The InChIKey is BYRWTSYZTVPYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O2/c1-29-22-11-15(6-7-16(22)13-28-29)17-10-20-18(4-2-8-26-20)23(12-17)31-14-21-19(24(25)30)5-3-9-27-21/h2-13H,14H2,1H3,(H2,25,30).
What are the key properties of 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide has a molecular weight of 409.45 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-(1-methylindazol-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide is sourced from PubChem (CID 71241914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).