2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide

C24H33N3O3 — CID 26274394

IUPAC2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide
SMILESCCc1c(C(=O)NCCc2ccc(O)cc2)c(=O)cc(C)n1CCN1CCCCC1
InChIInChI=1S/C24H33N3O3/c1-3-21-23(24(30)25-12-11-19-7-9-20(28)10-8-19)22(29)17-18(2)27(21)16-15-26-13-5-4-6-14-26/h7-10,17,28H,3-6,11-16H2,1-2H3,(H,25,30)
InChIKeyDTJUWPJUQJWJHI-UHFFFAOYSA-N
MW411.55 g/mol
LogP2.88
Rot. Bonds8

About 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide

2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide (PubChem CID 26274394) has the molecular formula C24H33N3O3 and a molecular weight of 411.55 g/mol. Its IUPAC name is 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide
PubChem CID26274394
Molecular FormulaC24H33N3O3
Molecular Weight411.55 g/mol
Exact Mass411.25
IUPAC Name2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide
SMILESCCc1c(C(=O)NCCc2ccc(O)cc2)c(=O)cc(C)n1CCN1CCCCC1
InChIInChI=1S/C24H33N3O3/c1-3-21-23(24(30)25-12-11-19-7-9-20(28)10-8-19)22(29)17-18(2)27(21)16-15-26-13-5-4-6-14-26/h7-10,17,28H,3-6,11-16H2,1-2H3,(H,25,30)
InChIKeyDTJUWPJUQJWJHI-UHFFFAOYSA-N
XLogP2.88
TPSA74.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide with MolForge

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Related Compounds

N-[2-(cyclohexen-1-yl)ethyl]-2-ethyl-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide
CID 26358697
2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]ethylcarbamic acid
CID 166746759
N-[2-(4-hydroxyphenyl)ethyl]-N'-(2-morpholin-4-ylethyl)oxamide
CID 108503044
N-[2-(4-hydroxyphenyl)ethyl]-1,5-dimethylpyrrole-2-carboxamide
CID 54903796
2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide
CID 76905886
3-hydroxy-6-methyl-1-(2-phenylethyl)-2-(pyrrolidin-1-ylmethyl)pyridin-4-one
CID 94959025
N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethylpyrazole-3-carboxamide
CID 61357227
2-[3-[3-[[2-(4-hydroxyphenyl)ethylamino]methyl]phenyl]phenyl]-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 139963138
2-[4-(3-piperidin-1-ylpropoxy)phenyl]ethylcarbamic acid
CID 166791828
3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097
2-amino-3-(4-hydroxyphenyl)-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 76893887
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide
CID 125144865

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide (CID 26274394) is 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide is CCc1c(C(=O)NCCc2ccc(O)cc2)c(=O)cc(C)n1CCN1CCCCC1.
What is the InChIKey of 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide?
The InChIKey is DTJUWPJUQJWJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O3/c1-3-21-23(24(30)25-12-11-19-7-9-20(28)10-8-19)22(29)17-18(2)27(21)16-15-26-13-5-4-6-14-26/h7-10,17,28H,3-6,11-16H2,1-2H3,(H,25,30).
What are the key properties of 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide?
2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide has a molecular weight of 411.55 g/mol, XLogP of 2.88, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-6-methyl-4-oxo-1-(2-piperidin-1-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 26274394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).