2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide

C13H18N2O3S — CID 83154940

IUPAC2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide
SMILESCc1cc(NC(=O)C(C)C2CC2)ccc1S(N)(=O)=O
InChIInChI=1S/C13H18N2O3S/c1-8-7-11(5-6-12(8)19(14,17)18)15-13(16)9(2)10-3-4-10/h5-7,9-10H,3-4H2,1-2H3,(H,15,16)(H2,14,17,18)
InChIKeyLBVWVFNEMPIEHA-UHFFFAOYSA-N
MW282.37 g/mol
LogP1.63
Rot. Bonds4

About 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide

2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide (PubChem CID 83154940) has the molecular formula C13H18N2O3S and a molecular weight of 282.37 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide
PubChem CID83154940
Molecular FormulaC13H18N2O3S
Molecular Weight282.37 g/mol
Exact Mass282.10
IUPAC Name2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide
SMILESCc1cc(NC(=O)C(C)C2CC2)ccc1S(N)(=O)=O
InChIInChI=1S/C13H18N2O3S/c1-8-7-11(5-6-12(8)19(14,17)18)15-13(16)9(2)10-3-4-10/h5-7,9-10H,3-4H2,1-2H3,(H,15,16)(H2,14,17,18)
InChIKeyLBVWVFNEMPIEHA-UHFFFAOYSA-N
XLogP1.63
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromo-4-methylphenyl)-2-cyclopropylpropanamide
CID 79505881
N-(3-amino-4-bromophenyl)-2-cyclopropylpropanamide
CID 83147329
2-cyclopropyl-N-(3,4-difluorophenyl)propanamide
CID 110428971
N-(3-methyl-4-sulfamoylphenyl)oxolane-2-carboxamide
CID 43133994
4-chloro-N-(3-methyl-4-sulfamoylphenyl)benzamide
CID 43246597
2-amino-N-(4-methyl-3-sulfamoylphenyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120784349
2-methyl-N-(4-methyl-3-sulfamoylphenyl)butanamide
CID 51331861
2-bromo-N-(3-methyl-4-sulfamoylphenyl)benzamide
CID 43134004
N-(2-chloro-6-methyl-4-sulfamoylphenyl)-2-cyclopropylpropanamide
CID 83154243
N-(3-methyl-4-sulfamoylphenyl)-2-(oxolan-2-yl)acetamide
CID 65155493
N-(3-methyl-4-sulfamoylphenyl)oxane-3-carboxamide
CID 63015081
2,2-dimethyl-N-(3-methyl-4-sulfamoylphenyl)butanamide
CID 62677678

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide?
The IUPAC name of 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide (CID 83154940) is 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide.
What is the SMILES notation for 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide?
The canonical SMILES for 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide is Cc1cc(NC(=O)C(C)C2CC2)ccc1S(N)(=O)=O.
What is the InChIKey of 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide?
The InChIKey is LBVWVFNEMPIEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-8-7-11(5-6-12(8)19(14,17)18)15-13(16)9(2)10-3-4-10/h5-7,9-10H,3-4H2,1-2H3,(H,15,16)(H2,14,17,18).
What are the key properties of 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide?
2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide has a molecular weight of 282.37 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 83154940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).