N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide

C19H16N2O2 — CID 24513585

IUPACN-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2Oc2ccccc2)c1
InChIInChI=1S/C19H16N2O2/c1-14-7-5-8-15(13-14)21-18(22)17-11-6-12-20-19(17)23-16-9-3-2-4-10-16/h2-13H,1H3,(H,21,22)
InChIKeyXMHJGVDHEFXBKS-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.43
Rot. Bonds4

About N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide

N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide (PubChem CID 24513585) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
PubChem CID24513585
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC NameN-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2Oc2ccccc2)c1
InChIInChI=1S/C19H16N2O2/c1-14-7-5-8-15(13-14)21-18(22)17-11-6-12-20-19(17)23-16-9-3-2-4-10-16/h2-13H,1H3,(H,21,22)
InChIKeyXMHJGVDHEFXBKS-UHFFFAOYSA-N
XLogP4.43
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide (CID 24513585) is N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide is Cc1cccc(NC(=O)c2cccnc2Oc2ccccc2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The InChIKey is XMHJGVDHEFXBKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-14-7-5-8-15(13-14)21-18(22)17-11-6-12-20-19(17)23-16-9-3-2-4-10-16/h2-13H,1H3,(H,21,22).
What are the key properties of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 24513585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).