[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten

C24H23N4O2W- — CID 155745678

IUPAC[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten
SMILES[NH-]c1ccccc1-c1ccc(N2CCCC(NC(=O)Nc3ccccc3)C2=O)cc1.[W]
InChIInChI=1S/C24H23N4O2.W/c25-21-10-5-4-9-20(21)17-12-14-19(15-13-17)28-16-6-11-22(23(28)29)27-24(30)26-18-7-2-1-3-8-18;/h1-5,7-10,12-15,22,25H,6,11,16H2,(H2,26,27,30);/q-1;
InChIKeyWCWSTHZVXFDTNA-UHFFFAOYSA-N
MW583.31 g/mol
LogP5.35
Rot. Bonds4

About [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten

[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten (PubChem CID 155745678) has the molecular formula C24H23N4O2W- and a molecular weight of 583.31 g/mol. Its IUPAC name is [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten.

Molecular Properties

Compound Name[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten
PubChem CID155745678
Molecular FormulaC24H23N4O2W-
Molecular Weight583.31 g/mol
Exact Mass583.13
IUPAC Name[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten
SMILES[NH-]c1ccccc1-c1ccc(N2CCCC(NC(=O)Nc3ccccc3)C2=O)cc1.[W]
InChIInChI=1S/C24H23N4O2.W/c25-21-10-5-4-9-20(21)17-12-14-19(15-13-17)28-16-6-11-22(23(28)29)27-24(30)26-18-7-2-1-3-8-18;/h1-5,7-10,12-15,22,25H,6,11,16H2,(H2,26,27,30);/q-1;
InChIKeyWCWSTHZVXFDTNA-UHFFFAOYSA-N
XLogP5.35
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500583.31
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten 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

1-[(3R)-2-oxo-1-[4-[2-(trifluoromethoxy)phenyl]phenyl]piperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 129226612
1-(2-oxo-1-pyridin-3-ylpiperidin-3-yl)-3-phenylurea
CID 166208852
1-[1-[4-(4-fluorophenyl)phenyl]-2-oxopiperidin-3-yl]-3-(4-methylphenyl)urea
CID 163572506
1-(1,3-benzodioxol-5-yl)-3-[(3R)-1-[4-(2-fluorophenyl)phenyl]-2-oxopiperidin-3-yl]urea
CID 142493615
1-[(3R)-1-[4-[2-(methanesulfonamidomethyl)phenyl]phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 129226953
1-[(3R)-1-[4-[2-(2-methylpropylsulfonylamino)phenyl]phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 129226617
1-[(3R)-1-[4-[2-(methylsulfanylamino)-3-pyridinyl]phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 166854887
N,N-dimethyl-5-[2-oxo-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]piperidin-1-yl]-2-phenylbenzamide
CID 175010397
1-[(3R)-1-[4-[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 146520329
1-[(3R)-1-[4-(4-fluoro-2-methoxyphenyl)phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 129227181
1-[(3R)-1-[4-(6-fluoro-2-pyridinyl)phenyl]-2-oxopiperidin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 142493644
1-[2-(aminomethyl)phenyl]-3-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]urea
CID 167807431

Frequently Asked Questions

What is the IUPAC name of [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten?
The IUPAC name of [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten (CID 155745678) is [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten.
What is the SMILES notation for [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten?
The canonical SMILES for [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten is [NH-]c1ccccc1-c1ccc(N2CCCC(NC(=O)Nc3ccccc3)C2=O)cc1.[W].
What is the InChIKey of [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten?
The InChIKey is WCWSTHZVXFDTNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N4O2.W/c25-21-10-5-4-9-20(21)17-12-14-19(15-13-17)28-16-6-11-22(23(28)29)27-24(30)26-18-7-2-1-3-8-18;/h1-5,7-10,12-15,22,25H,6,11,16H2,(H2,26,27,30);/q-1;.
What are the key properties of [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten?
[2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten has a molecular weight of 583.31 g/mol, XLogP of 5.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-[2-oxo-3-(phenylcarbamoylamino)piperidin-1-yl]phenyl]phenyl]azanide;tungsten is sourced from PubChem (CID 155745678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).