N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide

C18H19ClN2O3S — CID 4881219

IUPACN-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)C2CC2)ccc1Cl
InChIInChI=1S/C18H19ClN2O3S/c1-2-21(15-6-4-3-5-7-15)25(23,24)17-12-14(10-11-16(17)19)20-18(22)13-8-9-13/h3-7,10-13H,2,8-9H2,1H3,(H,20,22)
InChIKeyGSGGXZPASLSHKR-UHFFFAOYSA-N
MW378.88 g/mol
LogP3.90
Rot. Bonds6

About N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide

N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide (PubChem CID 4881219) has the molecular formula C18H19ClN2O3S and a molecular weight of 378.88 g/mol. Its IUPAC name is N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide
PubChem CID4881219
Molecular FormulaC18H19ClN2O3S
Molecular Weight378.88 g/mol
Exact Mass378.08
IUPAC NameN-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)C2CC2)ccc1Cl
InChIInChI=1S/C18H19ClN2O3S/c1-2-21(15-6-4-3-5-7-15)25(23,24)17-12-14(10-11-16(17)19)20-18(22)13-8-9-13/h3-7,10-13H,2,8-9H2,1H3,(H,20,22)
InChIKeyGSGGXZPASLSHKR-UHFFFAOYSA-N
XLogP3.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.88
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]acetamide
CID 3860347
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]acetamide
CID 720082
2-chloro-N-[4-chloro-3-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 138857440
N-[4-[methyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide
CID 974694
1-(benzenesulfonyl)-N-(4-chlorophenyl)piperidine-2-carboxamide
CID 4001201
N-(3-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide
CID 7926212
2-[Benzenesulfonyl-(4-chloro-phenyl)-amino]-N-ethyl-acetamide
CID 2271056
1-(4-chlorophenyl)-N-[4-(methylsulfamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 2980894
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 3280480
N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-3,3-dimethylbutanamide
CID 3525118
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 3954803
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide
CID 3962514

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide (CID 4881219) is N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide is CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)C2CC2)ccc1Cl.
What is the InChIKey of N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide?
The InChIKey is GSGGXZPASLSHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3S/c1-2-21(15-6-4-3-5-7-15)25(23,24)17-12-14(10-11-16(17)19)20-18(22)13-8-9-13/h3-7,10-13H,2,8-9H2,1H3,(H,20,22).
What are the key properties of N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide?
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide has a molecular weight of 378.88 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 4881219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).