N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide

C23H19N3O2 — CID 56596230

IUPACN-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1ccc(OCc2ccc3ccccc3n2)cc1
InChIInChI=1S/C23H19N3O2/c1-26(23(27)18-12-14-24-15-13-18)20-8-10-21(11-9-20)28-16-19-7-6-17-4-2-3-5-22(17)25-19/h2-15H,16H2,1H3
InChIKeyOUKKASCLDKRILK-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.49
Rot. Bonds5

About N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide

N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide (PubChem CID 56596230) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide
PubChem CID56596230
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1ccc(OCc2ccc3ccccc3n2)cc1
InChIInChI=1S/C23H19N3O2/c1-26(23(27)18-12-14-24-15-13-18)20-8-10-21(11-9-20)28-16-19-7-6-17-4-2-3-5-22(17)25-19/h2-15H,16H2,1H3
InChIKeyOUKKASCLDKRILK-UHFFFAOYSA-N
XLogP4.49
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide (CID 56596230) is N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide is CN(C(=O)c1ccncc1)c1ccc(OCc2ccc3ccccc3n2)cc1.
What is the InChIKey of N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide?
The InChIKey is OUKKASCLDKRILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-26(23(27)18-12-14-24-15-13-18)20-8-10-21(11-9-20)28-16-19-7-6-17-4-2-3-5-22(17)25-19/h2-15H,16H2,1H3.
What are the key properties of N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide?
N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide has a molecular weight of 369.42 g/mol, XLogP of 4.49, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(quinolin-2-ylmethoxy)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 56596230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).