N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide

C18H15N3O2 — CID 51038607

IUPACN-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(Oc3cccnc3)ccn2)c1
InChIInChI=1S/C18H15N3O2/c1-13-4-2-5-14(10-13)21-18(22)17-11-15(7-9-20-17)23-16-6-3-8-19-12-16/h2-12H,1H3,(H,21,22)
InChIKeyOZOSQHJXNGWMNG-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.83
Rot. Bonds4

About N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide

N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide (PubChem CID 51038607) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide
PubChem CID51038607
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC NameN-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(Oc3cccnc3)ccn2)c1
InChIInChI=1S/C18H15N3O2/c1-13-4-2-5-14(10-13)21-18(22)17-11-15(7-9-20-17)23-16-6-3-8-19-12-16/h2-12H,1H3,(H,21,22)
InChIKeyOZOSQHJXNGWMNG-UHFFFAOYSA-N
XLogP3.83
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide?
The IUPAC name of N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide (CID 51038607) is N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide is Cc1cccc(NC(=O)c2cc(Oc3cccnc3)ccn2)c1.
What is the InChIKey of N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide?
The InChIKey is OZOSQHJXNGWMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-13-4-2-5-14(10-13)21-18(22)17-11-15(7-9-20-17)23-16-6-3-8-19-12-16/h2-12H,1H3,(H,21,22).
What are the key properties of N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide?
N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-4-pyridin-3-yloxypyridine-2-carboxamide is sourced from PubChem (CID 51038607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).