N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine

C15H25N3O2S — CID 110611088

IUPACN-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine
SMILESCCNS(=O)(=O)NCC(Cc1ccccc1)N1CCCC1
InChIInChI=1S/C15H25N3O2S/c1-2-16-21(19,20)17-13-15(18-10-6-7-11-18)12-14-8-4-3-5-9-14/h3-5,8-9,15-17H,2,6-7,10-13H2,1H3
InChIKeyMQQKFTPTEGEVCU-UHFFFAOYSA-N
MW311.45 g/mol
LogP1.14
Rot. Bonds8

About N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine

N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 110611088) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID110611088
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC NameN-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine
SMILESCCNS(=O)(=O)NCC(Cc1ccccc1)N1CCCC1
InChIInChI=1S/C15H25N3O2S/c1-2-16-21(19,20)17-13-15(18-10-6-7-11-18)12-14-8-4-3-5-9-14/h3-5,8-9,15-17H,2,6-7,10-13H2,1H3
InChIKeyMQQKFTPTEGEVCU-UHFFFAOYSA-N
XLogP1.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylphenyl)-N-(3-phenyl-2-pyrrolidin-1-ylpropyl)methanesulfonamide
CID 110403948
N-(ethylsulfamoyl)-2-methyl-3-phenylpropan-1-amine
CID 110608620
N-[2-(4-methylpiperazin-1-yl)-3-phenylpropyl]methanesulfonamide
CID 110404077
methyl N-(3-phenyl-2-piperidin-1-ylpropyl)carbamate
CID 110403986
N-(2-morpholin-4-yl-3-phenylpropyl)benzenesulfonamide
CID 110403847
N-(ethylsulfamoyl)-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 110621642
N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
CID 110403541
1-benzyl-3-(3-phenyl-2-pyrrolidin-1-ylpropyl)urea
CID 110403915
N-(3-phenyl-2-piperidin-1-ylpropyl)cyclopropanecarboxamide
CID 110403968
2-cyclopropyl-N-(3-phenyl-2-pyrrolidin-1-ylpropyl)propanamide
CID 110611083
3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
CID 110420824
N-(3-phenyl-2-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide
CID 110403885

Frequently Asked Questions

What is the IUPAC name of N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine (CID 110611088) is N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine is CCNS(=O)(=O)NCC(Cc1ccccc1)N1CCCC1.
What is the InChIKey of N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is MQQKFTPTEGEVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-2-16-21(19,20)17-13-15(18-10-6-7-11-18)12-14-8-4-3-5-9-14/h3-5,8-9,15-17H,2,6-7,10-13H2,1H3.
What are the key properties of N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine?
N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 311.45 g/mol, XLogP of 1.14, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylsulfamoyl)-3-phenyl-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 110611088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).