N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide

C17H24N2O5S — CID 46596105

IUPACN-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide
SMILESCOCCOc1ccc(S(=O)(=O)N2CCCC2C(=O)NC2CC2)cc1
InChIInChI=1S/C17H24N2O5S/c1-23-11-12-24-14-6-8-15(9-7-14)25(21,22)19-10-2-3-16(19)17(20)18-13-4-5-13/h6-9,13,16H,2-5,10-12H2,1H3,(H,18,20)
InChIKeyRHKTXJGRWSMFTK-UHFFFAOYSA-N
MW368.46 g/mol
LogP1.14
Rot. Bonds8

About N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide

N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide (PubChem CID 46596105) has the molecular formula C17H24N2O5S and a molecular weight of 368.46 g/mol. Its IUPAC name is N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide
PubChem CID46596105
Molecular FormulaC17H24N2O5S
Molecular Weight368.46 g/mol
Exact Mass368.14
IUPAC NameN-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide
SMILESCOCCOc1ccc(S(=O)(=O)N2CCCC2C(=O)NC2CC2)cc1
InChIInChI=1S/C17H24N2O5S/c1-23-11-12-24-14-6-8-15(9-7-14)25(21,22)19-10-2-3-16(19)17(20)18-13-4-5-13/h6-9,13,16H,2-5,10-12H2,1H3,(H,18,20)
InChIKeyRHKTXJGRWSMFTK-UHFFFAOYSA-N
XLogP1.14
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide 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

(2R)-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 46105668
(2S)-1-(4-fluorophenyl)sulfonyl-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide
CID 51071510
1-(4-chlorophenyl)sulfonyl-N-cyclopropylpyrrolidine-2-carboxamide
CID 43011395
N-cyclopropyl-1-[4-(diethylsulfamoyl)phenyl]sulfonylpyrrolidine-2-carboxamide
CID 43062096
1-(4-bromophenyl)sulfonyl-N-cycloheptylpyrrolidine-2-carboxamide
CID 24617140
methyl 1-(4-ethoxyphenyl)sulfonylpyrrolidine-2-carboxylate
CID 43409870
N-tert-butyl-1-(4-ethoxyphenyl)sulfonylpyrrolidine-2-carboxamide
CID 18884790
(2S)-1-(4-chlorophenyl)sulfonyl-N-cyclopropylpiperidine-2-carboxamide
CID 92887706
(2S)-N-cyclopentyl-1-(4-fluorophenyl)sulfonylpiperidine-2-carboxamide
CID 92865510
1-(benzenesulfonyl)-N-cyclopentylpiperidine-2-carboxamide
CID 51159553
(2S)-N-cyclopropyl-1-naphthalen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 2295117
1-[4-(2-methoxyethoxy)phenyl]sulfonyl-N-methylpiperidin-3-amine
CID 120715200

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide (CID 46596105) is N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide is COCCOc1ccc(S(=O)(=O)N2CCCC2C(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide?
The InChIKey is RHKTXJGRWSMFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5S/c1-23-11-12-24-14-6-8-15(9-7-14)25(21,22)19-10-2-3-16(19)17(20)18-13-4-5-13/h6-9,13,16H,2-5,10-12H2,1H3,(H,18,20).
What are the key properties of N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide?
N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide has a molecular weight of 368.46 g/mol, XLogP of 1.14, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[4-(2-methoxyethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide is sourced from PubChem (CID 46596105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).