1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one

C18H24N2O — CID 62962661

IUPAC1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one
SMILESCCNC(Cn1ccc(C)cc1=O)c1ccc(C)cc1C
InChIInChI=1S/C18H24N2O/c1-5-19-17(16-7-6-13(2)10-15(16)4)12-20-9-8-14(3)11-18(20)21/h6-11,17,19H,5,12H2,1-4H3
InChIKeyMOPPCKGNFYLNTP-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.12
Rot. Bonds5

About 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one

1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one (PubChem CID 62962661) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one.

Molecular Properties

Compound Name1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one
PubChem CID62962661
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one
SMILESCCNC(Cn1ccc(C)cc1=O)c1ccc(C)cc1C
InChIInChI=1S/C18H24N2O/c1-5-19-17(16-7-6-13(2)10-15(16)4)12-20-9-8-14(3)11-18(20)21/h6-11,17,19H,5,12H2,1-4H3
InChIKeyMOPPCKGNFYLNTP-UHFFFAOYSA-N
XLogP3.12
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]pyrimidin-4-one
CID 63769355
1-[2-(2,5-dimethylphenyl)-2-(ethylamino)ethyl]-3-methylimidazol-2-one
CID 80580469
1-(2,4-dimethylphenyl)-N-ethyl-2-ethylsulfonylethanamine
CID 64647574
1-(2,4-dimethylphenyl)-N-ethyl-3,3,3-trifluoropropan-1-amine
CID 43490017
1-(2,4-dimethylphenyl)-N,3-diethylpentan-1-amine
CID 105028376
1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine
CID 115803668
1-[2-(ethylamino)-2-(2-methylphenyl)ethyl]-3-methylpyridin-2-one
CID 63172375
1-(2-aminopropyl)-4-methylpyridin-2-one
CID 62962673
1-(2,4-dimethylphenyl)-N-ethyl-2-propylsulfanylethanamine
CID 64614075
1-(2,4-dimethylphenyl)-N-ethyl-2-(4-methylphenoxy)ethanamine
CID 63474182
1-(2,4-dimethylphenyl)-N-ethyl-2-(2-methylphenyl)ethanamine
CID 43489975
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-4-methylpyridin-2-one
CID 62962498

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one?
The IUPAC name of 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one (CID 62962661) is 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one.
What is the SMILES notation for 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one?
The canonical SMILES for 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one is CCNC(Cn1ccc(C)cc1=O)c1ccc(C)cc1C.
What is the InChIKey of 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one?
The InChIKey is MOPPCKGNFYLNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-5-19-17(16-7-6-13(2)10-15(16)4)12-20-9-8-14(3)11-18(20)21/h6-11,17,19H,5,12H2,1-4H3.
What are the key properties of 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one?
1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one has a molecular weight of 284.40 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one is sourced from PubChem (CID 62962661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).