N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide

C20H26N4O3 — CID 163319585

IUPACN-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
SMILESCc1cccc(N2CCN(CC(=O)NCC(O)c3cccc(=O)[nH]3)CC2)c1
InChIInChI=1S/C20H26N4O3/c1-15-4-2-5-16(12-15)24-10-8-23(9-11-24)14-20(27)21-13-18(25)17-6-3-7-19(26)22-17/h2-7,12,18,25H,8-11,13-14H2,1H3,(H,21,27)(H,22,26)
InChIKeyCESHIBTWHJXNKP-UHFFFAOYSA-N
MW370.45 g/mol
LogP0.66
Rot. Bonds6

About N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide

N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide (PubChem CID 163319585) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
PubChem CID163319585
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC NameN-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
SMILESCc1cccc(N2CCN(CC(=O)NCC(O)c3cccc(=O)[nH]3)CC2)c1
InChIInChI=1S/C20H26N4O3/c1-15-4-2-5-16(12-15)24-10-8-23(9-11-24)14-20(27)21-13-18(25)17-6-3-7-19(26)22-17/h2-7,12,18,25H,8-11,13-14H2,1H3,(H,21,27)(H,22,26)
InChIKeyCESHIBTWHJXNKP-UHFFFAOYSA-N
XLogP0.66
TPSA88.67 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide 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

2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]acetamide
CID 163315890
N-(2,6-dimethylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34731939
2-[4-(3-methylphenyl)piperazin-1-yl]-N-[[(3S)-1-methylpiperidin-3-yl]methyl]acetamide
CID 95215856
N-[(2-chlorophenyl)methyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34732047
N-(2-tert-butylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34736252
N-cyclopropyl-2-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30649285
N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 91831816
2-[4-(3-methylphenyl)piperazin-1-yl]-N-[(4-methylthiadiazol-5-yl)methyl]acetamide
CID 91839293
2-[4-(3-methylphenyl)piperazin-1-yl]-N-[2-[(2R)-oxan-2-yl]ethyl]acetamide
CID 99974038
2-[4-(3-methylphenyl)piperazin-1-yl]-N-[2-(oxan-2-yl)ethyl]acetamide
CID 86285043
N-(3-acetylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 18124601
N-(4-acetylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 1448514

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide (CID 163319585) is N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide is Cc1cccc(N2CCN(CC(=O)NCC(O)c3cccc(=O)[nH]3)CC2)c1.
What is the InChIKey of N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide?
The InChIKey is CESHIBTWHJXNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-15-4-2-5-16(12-15)24-10-8-23(9-11-24)14-20(27)21-13-18(25)17-6-3-7-19(26)22-17/h2-7,12,18,25H,8-11,13-14H2,1H3,(H,21,27)(H,22,26).
What are the key properties of N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide?
N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide has a molecular weight of 370.45 g/mol, XLogP of 0.66, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(6-oxo-1H-pyridin-2-yl)ethyl]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 163319585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).