2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide

C19H24N2O2 — CID 4827424

IUPAC2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
SMILESCOc1ccccc1C(C)NCC(=O)NCc1ccc(C)cc1
InChIInChI=1S/C19H24N2O2/c1-14-8-10-16(11-9-14)12-21-19(22)13-20-15(2)17-6-4-5-7-18(17)23-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyDEDFOAOBUCKIBL-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.97
Rot. Bonds7

About 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide

2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 4827424) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
PubChem CID4827424
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
SMILESCOc1ccccc1C(C)NCC(=O)NCc1ccc(C)cc1
InChIInChI=1S/C19H24N2O2/c1-14-8-10-16(11-9-14)12-21-19(22)13-20-15(2)17-6-4-5-7-18(17)23-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyDEDFOAOBUCKIBL-UHFFFAOYSA-N
XLogP2.97
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide (CID 4827424) is 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide is COc1ccccc1C(C)NCC(=O)NCc1ccc(C)cc1.
What is the InChIKey of 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is DEDFOAOBUCKIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-14-8-10-16(11-9-14)12-21-19(22)13-20-15(2)17-6-4-5-7-18(17)23-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22).
What are the key properties of 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide?
2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 312.41 g/mol, XLogP of 2.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 4827424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).