4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide

C24H20N4O2 — CID 71010120

IUPAC4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2cc(Oc3ccccn3)ccc2C)cn1
InChIInChI=1S/C24H20N4O2/c1-16-6-8-19(30-23-5-3-4-11-26-23)13-20(16)18-7-9-22(27-14-18)28-24(29)21-15-25-12-10-17(21)2/h3-15H,1-2H3,(H,27,28,29)
InChIKeyNZWMPULZYTZWQM-UHFFFAOYSA-N
MW396.45 g/mol
LogP5.20
Rot. Bonds5

About 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide

4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 71010120) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide
PubChem CID71010120
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC Name4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2cc(Oc3ccccn3)ccc2C)cn1
InChIInChI=1S/C24H20N4O2/c1-16-6-8-19(30-23-5-3-4-11-26-23)13-20(16)18-7-9-22(27-14-18)28-24(29)21-15-25-12-10-17(21)2/h3-15H,1-2H3,(H,27,28,29)
InChIKeyNZWMPULZYTZWQM-UHFFFAOYSA-N
XLogP5.20
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.45
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide (CID 71010120) is 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide is Cc1ccncc1C(=O)Nc1ccc(-c2cc(Oc3ccccn3)ccc2C)cn1.
What is the InChIKey of 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is NZWMPULZYTZWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c1-16-6-8-19(30-23-5-3-4-11-26-23)13-20(16)18-7-9-22(27-14-18)28-24(29)21-15-25-12-10-17(21)2/h3-15H,1-2H3,(H,27,28,29).
What are the key properties of 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide?
4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 396.45 g/mol, XLogP of 5.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[5-(2-methyl-5-pyridin-2-yloxyphenyl)-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 71010120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).