N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide

C22H22N2O2 — CID 27757163

IUPACN-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1ccc(-c2ccccc2)nc1C
InChIInChI=1S/C22H22N2O2/c1-16-19(12-13-20(24-16)17-8-4-3-5-9-17)22(25)23-15-14-18-10-6-7-11-21(18)26-2/h3-13H,14-15H2,1-2H3,(H,23,25)
InChIKeyLWYDEXLOMJZPFC-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.04
Rot. Bonds6

About N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide

N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide (PubChem CID 27757163) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide
PubChem CID27757163
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1ccc(-c2ccccc2)nc1C
InChIInChI=1S/C22H22N2O2/c1-16-19(12-13-20(24-16)17-8-4-3-5-9-17)22(25)23-15-14-18-10-6-7-11-21(18)26-2/h3-13H,14-15H2,1-2H3,(H,23,25)
InChIKeyLWYDEXLOMJZPFC-UHFFFAOYSA-N
XLogP4.04
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide (CID 27757163) is N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide is COc1ccccc1CCNC(=O)c1ccc(-c2ccccc2)nc1C.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide?
The InChIKey is LWYDEXLOMJZPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-16-19(12-13-20(24-16)17-8-4-3-5-9-17)22(25)23-15-14-18-10-6-7-11-21(18)26-2/h3-13H,14-15H2,1-2H3,(H,23,25).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide?
N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide is sourced from PubChem (CID 27757163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).