N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide

C19H23N3O4S — CID 66576050

IUPACN-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide
SMILESCCCc1ccccc1NS(=O)(=O)c1cccc(NC(=O)NC(=O)CC)c1
InChIInChI=1S/C19H23N3O4S/c1-3-8-14-9-5-6-12-17(14)22-27(25,26)16-11-7-10-15(13-16)20-19(24)21-18(23)4-2/h5-7,9-13,22H,3-4,8H2,1-2H3,(H2,20,21,23,24)
InChIKeyYPKNONBGMVXIMV-UHFFFAOYSA-N
MW389.48 g/mol
LogP3.50
Rot. Bonds7

About N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide

N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide (PubChem CID 66576050) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide.

Molecular Properties

Compound NameN-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide
PubChem CID66576050
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC NameN-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide
SMILESCCCc1ccccc1NS(=O)(=O)c1cccc(NC(=O)NC(=O)CC)c1
InChIInChI=1S/C19H23N3O4S/c1-3-8-14-9-5-6-12-17(14)22-27(25,26)16-11-7-10-15(13-16)20-19(24)21-18(23)4-2/h5-7,9-13,22H,3-4,8H2,1-2H3,(H2,20,21,23,24)
InChIKeyYPKNONBGMVXIMV-UHFFFAOYSA-N
XLogP3.50
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 53.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide
CID 66576127
1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea
CID 4803235
4-bromo-3-fluoro-N-(2-propylphenyl)benzenesulfonamide
CID 103710385
2-(methylamino)-N-(2-propylphenyl)pyridine-4-sulfonamide
CID 62157255
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-methylbutanamide
CID 9415219
(2-propylphenyl) 3-(propylcarbamoylamino)benzenesulfonate
CID 66575971
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(4-ethoxyphenyl)propanamide
CID 60571618
N-[3-[(2-formylphenyl)sulfamoyl]phenyl]acetamide
CID 175447480
N-[2-(4-chloro-3-oxobutyl)phenyl]-3-methylbenzenesulfonamide
CID 163638553
1-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-propylurea
CID 4803273
3-N-(2-ethylphenyl)benzene-1,3-disulfonamide
CID 30286365
5-[(2-propylphenyl)sulfamoyl]furan-2-carboxylic acid
CID 43707205

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide?
The IUPAC name of N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide (CID 66576050) is N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide.
What is the SMILES notation for N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide?
The canonical SMILES for N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide is CCCc1ccccc1NS(=O)(=O)c1cccc(NC(=O)NC(=O)CC)c1.
What is the InChIKey of N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide?
The InChIKey is YPKNONBGMVXIMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-3-8-14-9-5-6-12-17(14)22-27(25,26)16-11-7-10-15(13-16)20-19(24)21-18(23)4-2/h5-7,9-13,22H,3-4,8H2,1-2H3,(H2,20,21,23,24).
What are the key properties of N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide?
N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide has a molecular weight of 389.48 g/mol, XLogP of 3.50, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide is sourced from PubChem (CID 66576050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).