2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide

C22H23N3O2 — CID 113011587

IUPAC2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCc3ccccc3C)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-16-7-10-20(11-8-16)27-15-22(26)25-19-9-12-21(24-14-19)23-13-18-6-4-3-5-17(18)2/h3-12,14H,13,15H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyBDQOOKMPIRARMJ-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.33
Rot. Bonds7

About 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide

2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide (PubChem CID 113011587) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide
PubChem CID113011587
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCc3ccccc3C)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-16-7-10-20(11-8-16)27-15-22(26)25-19-9-12-21(24-14-19)23-13-18-6-4-3-5-17(18)2/h3-12,14H,13,15H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyBDQOOKMPIRARMJ-UHFFFAOYSA-N
XLogP4.33
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 ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113012140
4-methyl-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011554
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113017290
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
N-[6-[(3,4-dimethoxyphenyl)methylamino]-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113014017
N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113027443
2-phenoxy-N-[6-(2,4,6-trimethylanilino)-3-pyridinyl]acetamide
CID 113017912
N-[6-(tert-butylamino)-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113014815
2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
CID 113012370
2-(4-chlorophenoxy)-N-[6-(2,6-dimethylanilino)-3-pyridinyl]acetamide
CID 113017182

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide (CID 113011587) is 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide is Cc1ccc(OCC(=O)Nc2ccc(NCc3ccccc3C)nc2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide?
The InChIKey is BDQOOKMPIRARMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-16-7-10-20(11-8-16)27-15-22(26)25-19-9-12-21(24-14-19)23-13-18-6-4-3-5-17(18)2/h3-12,14H,13,15H2,1-2H3,(H,23,24)(H,25,26).
What are the key properties of 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide?
2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide has a molecular weight of 361.45 g/mol, XLogP of 4.33, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide is sourced from PubChem (CID 113011587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).