3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide

C15H20ClFN2O3S — CID 55914836

IUPAC3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(Cl)cc1F)NC1CCCCC1
InChIInChI=1S/C15H20ClFN2O3S/c16-11-6-7-14(13(17)10-11)23(21,22)18-9-8-15(20)19-12-4-2-1-3-5-12/h6-7,10,12,18H,1-5,8-9H2,(H,19,20)
InChIKeyGDIXNZASIZFHGJ-UHFFFAOYSA-N
MW362.85 g/mol
LogP2.60
Rot. Bonds6

About 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide

3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide (PubChem CID 55914836) has the molecular formula C15H20ClFN2O3S and a molecular weight of 362.85 g/mol. Its IUPAC name is 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide.

Molecular Properties

Compound Name3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide
PubChem CID55914836
Molecular FormulaC15H20ClFN2O3S
Molecular Weight362.85 g/mol
Exact Mass362.09
IUPAC Name3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(Cl)cc1F)NC1CCCCC1
InChIInChI=1S/C15H20ClFN2O3S/c16-11-6-7-14(13(17)10-11)23(21,22)18-9-8-15(20)19-12-4-2-1-3-5-12/h6-7,10,12,18H,1-5,8-9H2,(H,19,20)
InChIKeyGDIXNZASIZFHGJ-UHFFFAOYSA-N
XLogP2.60
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.85
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-methylpropanamide
CID 47062283
N-cyclohexyl-2-[(2,4-difluorophenyl)sulfonylamino]acetamide
CID 51099663
4-[(4-bromo-2-fluorophenyl)sulfonylamino]-N-cyclopropylbutanamide
CID 116528718
3-(3-chloroanilino)-N-cycloheptylpropanamide
CID 109031475
3-(benzenesulfonamido)-N-cyclohexylpropanamide
CID 17225810
N-cycloheptyl-3-(3,4-difluoroanilino)propanamide
CID 109031550
N-cyclohexyl-3-(3,5-dichloroanilino)propanamide
CID 109014092
3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide
CID 113220281
N-cycloheptyl-3-(3,4-dichloroanilino)propanamide
CID 109031534
4-chloro-2-fluoro-N-(2-piperidin-1-ylethyl)benzenesulfonamide
CID 47206353
4-chloro-N-cycloheptyl-2-fluorobenzamide
CID 26002204
propan-2-yl 3-[(4-chloro-2-fluorophenyl)sulfonylamino]propanoate
CID 47121966

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide?
The IUPAC name of 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide (CID 55914836) is 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide.
What is the SMILES notation for 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide?
The canonical SMILES for 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide is O=C(CCNS(=O)(=O)c1ccc(Cl)cc1F)NC1CCCCC1.
What is the InChIKey of 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide?
The InChIKey is GDIXNZASIZFHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClFN2O3S/c16-11-6-7-14(13(17)10-11)23(21,22)18-9-8-15(20)19-12-4-2-1-3-5-12/h6-7,10,12,18H,1-5,8-9H2,(H,19,20).
What are the key properties of 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide?
3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide has a molecular weight of 362.85 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide is sourced from PubChem (CID 55914836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).