2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide

C22H18N4O3 — CID 71241924

IUPAC2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
SMILESCOc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1
InChIInChI=1S/C22H18N4O3/c1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h2-12H,13H2,1H3,(H2,23,27)
InChIKeyVAZMBEVRNVUFAD-UHFFFAOYSA-N
MW386.41 g/mol
LogP3.38
Rot. Bonds6

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

2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide (PubChem CID 71241924) has the molecular formula C22H18N4O3 and a molecular weight of 386.41 g/mol. Its IUPAC name is 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
PubChem CID71241924
Molecular FormulaC22H18N4O3
Molecular Weight386.41 g/mol
Exact Mass386.14
IUPAC Name2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
SMILESCOc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1
InChIInChI=1S/C22H18N4O3/c1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h2-12H,13H2,1H3,(H2,23,27)
InChIKeyVAZMBEVRNVUFAD-UHFFFAOYSA-N
XLogP3.38
TPSA100.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The IUPAC name of 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide (CID 71241924) is 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide is COc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1.
What is the InChIKey of 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
The InChIKey is VAZMBEVRNVUFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O3/c1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h2-12H,13H2,1H3,(H2,23,27).
What are the key properties of 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide?
2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide has a molecular weight of 386.41 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide is sourced from PubChem (CID 71241924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).