(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide

C15H23ClN4O4S — CID 18727164

IUPAC(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide
SMILESCCC[C@@H](NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)NO
InChIInChI=1S/C15H23ClN4O4S/c1-2-3-14(15(21)17-22)18-25(23,24)20-10-8-19(9-11-20)13-6-4-12(16)5-7-13/h4-7,14,18,22H,2-3,8-11H2,1H3,(H,17,21)/t14-/m1/s1
InChIKeyOSRPJWLCUYFDAR-CQSZACIVSA-N
MW390.89 g/mol
LogP0.97
Rot. Bonds7

About (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide

(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide (PubChem CID 18727164) has the molecular formula C15H23ClN4O4S and a molecular weight of 390.89 g/mol. Its IUPAC name is (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide.

Molecular Properties

Compound Name(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide
PubChem CID18727164
Molecular FormulaC15H23ClN4O4S
Molecular Weight390.89 g/mol
Exact Mass390.11
IUPAC Name(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide
SMILESCCC[C@@H](NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)NO
InChIInChI=1S/C15H23ClN4O4S/c1-2-3-14(15(21)17-22)18-25(23,24)20-10-8-19(9-11-20)13-6-4-12(16)5-7-13/h4-7,14,18,22H,2-3,8-11H2,1H3,(H,17,21)/t14-/m1/s1
InChIKeyOSRPJWLCUYFDAR-CQSZACIVSA-N
XLogP0.97
TPSA101.98 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.89
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-6-amino-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxyhexanamide
CID 18727269
(2R)-2-[[4-(5-chloro-2-pyridinyl)piperazin-1-yl]sulfonylamino]-N-hydroxybutanamide
CID 139983361
(2R)-2-[benzyl-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypropanamide
CID 18727267
(2S)-2-[[4-[4-[(E)-2-(8-carbamoylnaphthalen-2-yl)ethenyl]phenyl]piperazin-1-yl]sulfonylamino]pentanoic acid
CID 68587072
N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]butanamide
CID 41349861
N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]propanamide
CID 41349860
3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-hydroxybenzamide
CID 18413944
N-butyl-3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylthiophene-2-carboxamide
CID 53076889
N-[2-[[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl]amino]-2-oxoethyl]propanamide
CID 51131186
2-chloro-N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]acetamide
CID 41349884
3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-(2-methylpropyl)-1-propylpyrazole-4-carboxamide
CID 53142824
trans-(1S,3R)-1-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-2-methyl-3-phenylcyclopropane-1-carboxylic acid
CID 70897945

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide?
The IUPAC name of (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide (CID 18727164) is (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide.
What is the SMILES notation for (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide?
The canonical SMILES for (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide is CCC[C@@H](NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)NO.
What is the InChIKey of (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide?
The InChIKey is OSRPJWLCUYFDAR-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23ClN4O4S/c1-2-3-14(15(21)17-22)18-25(23,24)20-10-8-19(9-11-20)13-6-4-12(16)5-7-13/h4-7,14,18,22H,2-3,8-11H2,1H3,(H,17,21)/t14-/m1/s1.
What are the key properties of (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide?
(2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide has a molecular weight of 390.89 g/mol, XLogP of 0.97, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylamino]-N-hydroxypentanamide is sourced from PubChem (CID 18727164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).