6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide

C22H23N3O2 — CID 109158318

IUPAC6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1Nc1ccc(C(=O)NCCc2ccccc2)cn1
InChIInChI=1S/C22H23N3O2/c1-16-8-10-20(27-2)19(14-16)25-21-11-9-18(15-24-21)22(26)23-13-12-17-6-4-3-5-7-17/h3-11,14-15H,12-13H2,1-2H3,(H,23,26)(H,24,25)
InChIKeyGGAVXICGEWPJCE-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.11
Rot. Bonds7

About 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide

6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide (PubChem CID 109158318) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
PubChem CID109158318
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1Nc1ccc(C(=O)NCCc2ccccc2)cn1
InChIInChI=1S/C22H23N3O2/c1-16-8-10-20(27-2)19(14-16)25-21-11-9-18(15-24-21)22(26)23-13-12-17-6-4-3-5-7-17/h3-11,14-15H,12-13H2,1-2H3,(H,23,26)(H,24,25)
InChIKeyGGAVXICGEWPJCE-UHFFFAOYSA-N
XLogP4.11
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-methoxy-5-methylanilino)-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109160854
6-(2-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109158959
6-(4-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 1441265
6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 1447920
2-(2-methoxy-5-methylanilino)-N-[2-(3-methoxyphenyl)ethyl]pyrimidine-5-carboxamide
CID 109260370
6-(5-chloro-2-methoxyanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109158583
2-(2-methoxy-5-methylanilino)-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-5-carboxamide
CID 109260242
6-(2-methoxy-5-methylanilino)-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109159231
6-(5-chloro-2-methoxyanilino)-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 109156064
6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109164093
N-[2-(2-methoxyphenyl)ethyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109158821
6-(2-methoxy-5-methylanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109164204

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide (CID 109158318) is 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide is COc1ccc(C)cc1Nc1ccc(C(=O)NCCc2ccccc2)cn1.
What is the InChIKey of 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The InChIKey is GGAVXICGEWPJCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-16-8-10-20(27-2)19(14-16)25-21-11-9-18(15-24-21)22(26)23-13-12-17-6-4-3-5-7-17/h3-11,14-15H,12-13H2,1-2H3,(H,23,26)(H,24,25).
What are the key properties of 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide?
6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.11, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 109158318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).