6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one

C16H20N2O — CID 144545636

IUPAC6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
SMILESCCc1cc(C)c(=O)[nH]c1-c1ccc(N(C)C)cc1
InChIInChI=1S/C16H20N2O/c1-5-12-10-11(2)16(19)17-15(12)13-6-8-14(9-7-13)18(3)4/h6-10H,5H2,1-4H3,(H,17,19)
InChIKeyLLVGNMOIDGCHSH-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.98
Rot. Bonds3

About 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one

6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one (PubChem CID 144545636) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
PubChem CID144545636
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
SMILESCCc1cc(C)c(=O)[nH]c1-c1ccc(N(C)C)cc1
InChIInChI=1S/C16H20N2O/c1-5-12-10-11(2)16(19)17-15(12)13-6-8-14(9-7-13)18(3)4/h6-10H,5H2,1-4H3,(H,17,19)
InChIKeyLLVGNMOIDGCHSH-UHFFFAOYSA-N
XLogP2.98
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one?
The IUPAC name of 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one (CID 144545636) is 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one.
What is the SMILES notation for 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one?
The canonical SMILES for 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one is CCc1cc(C)c(=O)[nH]c1-c1ccc(N(C)C)cc1.
What is the InChIKey of 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one?
The InChIKey is LLVGNMOIDGCHSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-5-12-10-11(2)16(19)17-15(12)13-6-8-14(9-7-13)18(3)4/h6-10H,5H2,1-4H3,(H,17,19).
What are the key properties of 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one?
6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one has a molecular weight of 256.35 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one is sourced from PubChem (CID 144545636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).