3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide

C22H25N3O3S — CID 55570240

IUPAC3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C22H25N3O3S/c26-22(23-14-13-17-15-24-21-4-2-1-3-20(17)21)12-7-16-5-10-19(11-6-16)29(27,28)25-18-8-9-18/h1-6,10-11,15,18,24-25H,7-9,12-14H2,(H,23,26)
InChIKeyMGMKUVREMVMXIF-UHFFFAOYSA-N
MW411.53 g/mol
LogP2.90
Rot. Bonds9

About 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide

3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide (PubChem CID 55570240) has the molecular formula C22H25N3O3S and a molecular weight of 411.53 g/mol. Its IUPAC name is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
PubChem CID55570240
Molecular FormulaC22H25N3O3S
Molecular Weight411.53 g/mol
Exact Mass411.16
IUPAC Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C22H25N3O3S/c26-22(23-14-13-17-15-24-21-4-2-1-3-20(17)21)12-7-16-5-10-19(11-6-16)29(27,28)25-18-8-9-18/h1-6,10-11,15,18,24-25H,7-9,12-14H2,(H,23,26)
InChIKeyMGMKUVREMVMXIF-UHFFFAOYSA-N
XLogP2.90
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.53
LogP ≤ 52.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-aminophenyl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 28712929
N-[2-(1H-indol-3-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 16574540
3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 30867031
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(benzenesulfonamido)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27644763
3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 18107802
4-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoate
CID 7019224
N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
CID 109058300
3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,2-diphenylethyl)propanamide
CID 55570051
3-chloro-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 588711
3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 2108565
3-(1H-indol-3-yl)-N-(2-sulfamoylethyl)propanamide
CID 43582891

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide (CID 55570240) is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide is O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NCCc1c[nH]c2ccccc12.
What is the InChIKey of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The InChIKey is MGMKUVREMVMXIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3S/c26-22(23-14-13-17-15-24-21-4-2-1-3-20(17)21)12-7-16-5-10-19(11-6-16)29(27,28)25-18-8-9-18/h1-6,10-11,15,18,24-25H,7-9,12-14H2,(H,23,26).
What are the key properties of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide has a molecular weight of 411.53 g/mol, XLogP of 2.90, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide is sourced from PubChem (CID 55570240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).