2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide

C12H15BrN2O3S — CID 5025044

IUPAC2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide
SMILESCC(NS(=O)(=O)c1ccc(Br)cc1)C(=O)NC1CC1
InChIInChI=1S/C12H15BrN2O3S/c1-8(12(16)14-10-4-5-10)15-19(17,18)11-6-2-9(13)3-7-11/h2-3,6-8,10,15H,4-5H2,1H3,(H,14,16)
InChIKeyFSUVVGYUGXTCQK-UHFFFAOYSA-N
MW347.23 g/mol
LogP1.39
Rot. Bonds5

About 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide

2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide (PubChem CID 5025044) has the molecular formula C12H15BrN2O3S and a molecular weight of 347.23 g/mol. Its IUPAC name is 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide
PubChem CID5025044
Molecular FormulaC12H15BrN2O3S
Molecular Weight347.23 g/mol
Exact Mass346.00
IUPAC Name2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide
SMILESCC(NS(=O)(=O)c1ccc(Br)cc1)C(=O)NC1CC1
InChIInChI=1S/C12H15BrN2O3S/c1-8(12(16)14-10-4-5-10)15-19(17,18)11-6-2-9(13)3-7-11/h2-3,6-8,10,15H,4-5H2,1H3,(H,14,16)
InChIKeyFSUVVGYUGXTCQK-UHFFFAOYSA-N
XLogP1.39
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.23
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(4-bromophenyl)sulfonylamino]-N-cyclopentylpropanamide
CID 40746707
2-[(4-bromophenyl)sulfonylamino]-N-cycloheptylpropanamide
CID 2955440
(2R)-2-[(4-bromophenyl)sulfonylamino]-N-methylpropanamide
CID 41330953
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-cycloheptylpropanamide
CID 51122843
(2R)-N-cyclopropyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 7369499
(2R)-2-[(4-bromophenyl)sulfonylamino]-N-phenylpropanamide
CID 1296182
2-[(4-bromophenyl)sulfonylamino]-N-propylpropanamide
CID 4312518
(2S)-2-[(4-bromophenyl)sulfonylamino]-N-(3,5-dimethylphenyl)propanamide
CID 41373401
N-(4-bromophenyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 50740332
(2S)-2-[(4-bromophenyl)sulfonylamino]-N-butylpropanamide
CID 40579947
4-bromo-N-[(1R)-1-cyclopropylethyl]benzenesulfonamide
CID 8816866
2-[(4-bromophenyl)sulfonylamino]-N-prop-2-enylpropanamide
CID 4531040

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide?
The IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide (CID 5025044) is 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide.
What is the SMILES notation for 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide?
The canonical SMILES for 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide is CC(NS(=O)(=O)c1ccc(Br)cc1)C(=O)NC1CC1.
What is the InChIKey of 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide?
The InChIKey is FSUVVGYUGXTCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN2O3S/c1-8(12(16)14-10-4-5-10)15-19(17,18)11-6-2-9(13)3-7-11/h2-3,6-8,10,15H,4-5H2,1H3,(H,14,16).
What are the key properties of 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide?
2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide has a molecular weight of 347.23 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenyl)sulfonylamino]-N-cyclopropylpropanamide is sourced from PubChem (CID 5025044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).