2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide

C18H29N3O4S — CID 119531108

IUPAC2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide
SMILESCCCN(C(=O)CS(=O)(=O)Nc1ccc(OC(C)C)cc1)C1CCNC1
InChIInChI=1S/C18H29N3O4S/c1-4-11-21(16-9-10-19-12-16)18(22)13-26(23,24)20-15-5-7-17(8-6-15)25-14(2)3/h5-8,14,16,19-20H,4,9-13H2,1-3H3
InChIKeyNDFZYWLPBMFXBI-UHFFFAOYSA-N
MW383.51 g/mol
LogP1.82
Rot. Bonds9

About 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide

2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide (PubChem CID 119531108) has the molecular formula C18H29N3O4S and a molecular weight of 383.51 g/mol. Its IUPAC name is 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound Name2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide
PubChem CID119531108
Molecular FormulaC18H29N3O4S
Molecular Weight383.51 g/mol
Exact Mass383.19
IUPAC Name2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide
SMILESCCCN(C(=O)CS(=O)(=O)Nc1ccc(OC(C)C)cc1)C1CCNC1
InChIInChI=1S/C18H29N3O4S/c1-4-11-21(16-9-10-19-12-16)18(22)13-26(23,24)20-15-5-7-17(8-6-15)25-14(2)3/h5-8,14,16,19-20H,4,9-13H2,1-3H3
InChIKeyNDFZYWLPBMFXBI-UHFFFAOYSA-N
XLogP1.82
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.51
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide 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

2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119451342
N-propyl-4-(propylsulfonylamino)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119530957
N-piperidin-4-yl-2-[(4-propan-2-yloxyphenyl)sulfamoyl]acetamide
CID 119387593
2-(4-methoxyphenoxy)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532521
N-(2-piperidin-3-ylethyl)-2-[(4-propan-2-yloxyphenyl)sulfamoyl]acetamide
CID 119556769
2-oxo-2-piperazin-1-yl-N-(4-propan-2-yloxyphenyl)ethanesulfonamide
CID 119401538
2-[propan-2-yl-[2-[(4-propan-2-yloxyphenyl)sulfamoyl]acetyl]amino]acetic acid
CID 119198613
2-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 60807367
2-(4-chlorophenoxy)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 63301188
3-propan-2-yloxy-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119530419
4-(2-methylpropanoylamino)-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 119532098
N-piperidin-4-yl-2-(2-propan-2-yloxyphenyl)-N-propylacetamide
CID 119823731

Frequently Asked Questions

What is the IUPAC name of 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide?
The IUPAC name of 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide (CID 119531108) is 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide is CCCN(C(=O)CS(=O)(=O)Nc1ccc(OC(C)C)cc1)C1CCNC1.
What is the InChIKey of 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide?
The InChIKey is NDFZYWLPBMFXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O4S/c1-4-11-21(16-9-10-19-12-16)18(22)13-26(23,24)20-15-5-7-17(8-6-15)25-14(2)3/h5-8,14,16,19-20H,4,9-13H2,1-3H3.
What are the key properties of 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide?
2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide has a molecular weight of 383.51 g/mol, XLogP of 1.82, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-propan-2-yloxyphenyl)sulfamoyl]-N-propyl-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 119531108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).