N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C14H19ClN2O3S — CID 66475777

IUPACN-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)C1(C)C
InChIInChI=1S/C14H19ClN2O3S/c1-13(2)11(14(13,3)4)12(18)17-10-6-5-8(7-9(10)15)21(16,19)20/h5-7,11H,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyCOYBSPMJFNGCGX-UHFFFAOYSA-N
MW330.84 g/mol
LogP2.61
Rot. Bonds3

About N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 66475777) has the molecular formula C14H19ClN2O3S and a molecular weight of 330.84 g/mol. Its IUPAC name is N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID66475777
Molecular FormulaC14H19ClN2O3S
Molecular Weight330.84 g/mol
Exact Mass330.08
IUPAC NameN-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)C1(C)C
InChIInChI=1S/C14H19ClN2O3S/c1-13(2)11(14(13,3)4)12(18)17-10-6-5-8(7-9(10)15)21(16,19)20/h5-7,11H,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyCOYBSPMJFNGCGX-UHFFFAOYSA-N
XLogP2.61
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.84
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-5-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66476009
N-(2-chloro-4-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
CID 107180012
N-(4-carbamothioyl-2-chlorophenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 107808560
4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
CID 43134088
N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide
CID 43246729
N-(2-chloro-4-sulfamoylphenyl)pentanamide
CID 43134096
N-(2-chloro-4-sulfamoylphenyl)-3-sulfanylpropanamide
CID 23645367
N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 43134081
N-(2-chloro-4-sulfamoylphenyl)-2-ethylhexanamide
CID 43246745
5-bromo-N-(2-chloro-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 62958134
N-(2-chloro-5-sulfamoylphenyl)cyclobutanecarboxamide
CID 61131077
tert-butyl N-[3-(2-chloro-4-sulfamoylanilino)-3-oxopropyl]carbamate
CID 10667340

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 66475777) is N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)C1(C)C.
What is the InChIKey of N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is COYBSPMJFNGCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3S/c1-13(2)11(14(13,3)4)12(18)17-10-6-5-8(7-9(10)15)21(16,19)20/h5-7,11H,1-4H3,(H,17,18)(H2,16,19,20).
What are the key properties of N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 330.84 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 66475777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).