N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide

C23H25N3O2 — CID 113013483

IUPACN-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide
SMILESCOc1ccc(CCNc2ccc(NC(=O)Cc3ccc(C)cc3)cn2)cc1
InChIInChI=1S/C23H25N3O2/c1-17-3-5-19(6-4-17)15-23(27)26-20-9-12-22(25-16-20)24-14-13-18-7-10-21(28-2)11-8-18/h3-12,16H,13-15H2,1-2H3,(H,24,25)(H,26,27)
InChIKeyGKQWBUHOGFFSFZ-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.23
Rot. Bonds8

About N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide

N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide (PubChem CID 113013483) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide
PubChem CID113013483
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide
SMILESCOc1ccc(CCNc2ccc(NC(=O)Cc3ccc(C)cc3)cn2)cc1
InChIInChI=1S/C23H25N3O2/c1-17-3-5-19(6-4-17)15-23(27)26-20-9-12-22(25-16-20)24-14-13-18-7-10-21(28-2)11-8-18/h3-12,16H,13-15H2,1-2H3,(H,24,25)(H,26,27)
InChIKeyGKQWBUHOGFFSFZ-UHFFFAOYSA-N
XLogP4.23
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide (CID 113013483) is N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide is COc1ccc(CCNc2ccc(NC(=O)Cc3ccc(C)cc3)cn2)cc1.
What is the InChIKey of N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide?
The InChIKey is GKQWBUHOGFFSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-17-3-5-19(6-4-17)15-23(27)26-20-9-12-22(25-16-20)24-14-13-18-7-10-21(28-2)11-8-18/h3-12,16H,13-15H2,1-2H3,(H,24,25)(H,26,27).
What are the key properties of N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide?
N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide has a molecular weight of 375.47 g/mol, XLogP of 4.23, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 113013483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).