N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide

C22H23N3O3 — CID 109156154

IUPACN-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(C)c3ccccc3)nc2)c(OC)c1
InChIInChI=1S/C22H23N3O3/c1-15(16-7-5-4-6-8-16)24-21-12-9-17(14-23-21)22(26)25-19-11-10-18(27-2)13-20(19)28-3/h4-15H,1-3H3,(H,23,24)(H,25,26)
InChIKeyDROWXIFKXTVYMR-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.52
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide

N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide (PubChem CID 109156154) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
PubChem CID109156154
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(C)c3ccccc3)nc2)c(OC)c1
InChIInChI=1S/C22H23N3O3/c1-15(16-7-5-4-6-8-16)24-21-12-9-17(14-23-21)22(26)25-19-11-10-18(27-2)13-20(19)28-3/h4-15H,1-3H3,(H,23,24)(H,25,26)
InChIKeyDROWXIFKXTVYMR-UHFFFAOYSA-N
XLogP4.52
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,4-dimethoxyanilino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109163030
N-(2-bromophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156169
6-(2-cyanoanilino)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109164359
N-(2,4-dimethoxyphenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 109162325
N-(2,4-dimethoxyphenyl)-6-(2,3-dimethylanilino)pyridine-3-carboxamide
CID 109162768
4-methoxy-N-[6-(1-phenylethylamino)pyridazin-3-yl]benzamide
CID 113041179
2,4-dimethoxy-N-(1-phenylethyl)aniline
CID 11586940
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
2-(benzylamino)-N-(2,4-dimethoxyphenyl)pyrimidine-5-carboxamide
CID 109255477
N-(2,4-dimethoxyphenyl)-6-pyrimidin-5-ylpyridine-3-carboxamide
CID 53149802
N-(4-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156139
N-(2-methoxyethyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109152988

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide (CID 109156154) is N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide is COc1ccc(NC(=O)c2ccc(NC(C)c3ccccc3)nc2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The InChIKey is DROWXIFKXTVYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15(16-7-5-4-6-8-16)24-21-12-9-17(14-23-21)22(26)25-19-11-10-18(27-2)13-20(19)28-3/h4-15H,1-3H3,(H,23,24)(H,25,26).
What are the key properties of N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109156154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).