N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide

C24H31N5O3 — CID 117094656

IUPACN-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide
SMILESCCN(CC)C(=O)C1CCCN(c2cccc(C(=O)Nc3ccc(NC(C)=O)cc3)n2)C1
InChIInChI=1S/C24H31N5O3/c1-4-28(5-2)24(32)18-8-7-15-29(16-18)22-10-6-9-21(27-22)23(31)26-20-13-11-19(12-14-20)25-17(3)30/h6,9-14,18H,4-5,7-8,15-16H2,1-3H3,(H,25,30)(H,26,31)
InChIKeyFOGGUVQRVYTVCW-UHFFFAOYSA-N
MW437.54 g/mol
LogP3.38
Rot. Bonds7

About N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide

N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide (PubChem CID 117094656) has the molecular formula C24H31N5O3 and a molecular weight of 437.54 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide
PubChem CID117094656
Molecular FormulaC24H31N5O3
Molecular Weight437.54 g/mol
Exact Mass437.24
IUPAC NameN-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide
SMILESCCN(CC)C(=O)C1CCCN(c2cccc(C(=O)Nc3ccc(NC(C)=O)cc3)n2)C1
InChIInChI=1S/C24H31N5O3/c1-4-28(5-2)24(32)18-8-7-15-29(16-18)22-10-6-9-21(27-22)23(31)26-20-13-11-19(12-14-20)25-17(3)30/h6,9-14,18H,4-5,7-8,15-16H2,1-3H3,(H,25,30)(H,26,31)
InChIKeyFOGGUVQRVYTVCW-UHFFFAOYSA-N
XLogP3.38
TPSA94.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.54
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide
CID 117088957
N-benzyl-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide
CID 117094335
(3S)-1-N-[4-[[(3S)-3-(diethylcarbamoyl)piperidine-1-carbonyl]amino]phenyl]-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 40620948
2-[3-(diethylcarbamoyl)piperidin-1-yl]-N-(3,4,5-trimethoxyphenyl)pyridine-4-carboxamide
CID 117093679
2-[3-(diethylcarbamoyl)piperidin-1-yl]-N-propylpyridine-4-carboxamide
CID 117090636
1-N-(4-chlorophenyl)-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 3697126
N-(3,4-dimethylphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573565
N-(3,5-dimethylphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573584
1-N-[3-[[3-(diethylcarbamoyl)piperidine-1-carbonyl]amino]phenyl]-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 3574463
N-ethyl-N-(2-hydroxyethyl)-6-piperidin-1-ylpyridine-2-carboxamide
CID 84575190
N-(4-acetamidophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095228
1-(6-cyanopyrazin-2-yl)-N,N-diethylpiperidine-3-carboxamide
CID 132776180

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide (CID 117094656) is N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide is CCN(CC)C(=O)C1CCCN(c2cccc(C(=O)Nc3ccc(NC(C)=O)cc3)n2)C1.
What is the InChIKey of N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide?
The InChIKey is FOGGUVQRVYTVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N5O3/c1-4-28(5-2)24(32)18-8-7-15-29(16-18)22-10-6-9-21(27-22)23(31)26-20-13-11-19(12-14-20)25-17(3)30/h6,9-14,18H,4-5,7-8,15-16H2,1-3H3,(H,25,30)(H,26,31).
What are the key properties of N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide?
N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide has a molecular weight of 437.54 g/mol, XLogP of 3.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-6-[3-(diethylcarbamoyl)piperidin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 117094656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).