N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide

C17H25FN4O3S — CID 33363762

IUPACN-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(S(=O)(=O)N2CCCC2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C17H25FN4O3S/c18-15-4-3-5-16(14-15)19-17(23)6-9-20-10-12-22(13-11-20)26(24,25)21-7-1-2-8-21/h3-5,14H,1-2,6-13H2,(H,19,23)
InChIKeyUTSTYENTLJCXJU-UHFFFAOYSA-N
MW384.48 g/mol
LogP1.11
Rot. Bonds6

About N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide

N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide (PubChem CID 33363762) has the molecular formula C17H25FN4O3S and a molecular weight of 384.48 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide
PubChem CID33363762
Molecular FormulaC17H25FN4O3S
Molecular Weight384.48 g/mol
Exact Mass384.16
IUPAC NameN-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(S(=O)(=O)N2CCCC2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C17H25FN4O3S/c18-15-4-3-5-16(14-15)19-17(23)6-9-20-10-12-22(13-11-20)26(24,25)21-7-1-2-8-21/h3-5,14H,1-2,6-13H2,(H,19,23)
InChIKeyUTSTYENTLJCXJU-UHFFFAOYSA-N
XLogP1.11
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)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

N-(3-fluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
CID 43037946
N-(3-fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide
CID 740647
3-(4-ethynyl-4-hydroxypiperidin-1-yl)-N-(3-fluorophenyl)propanamide
CID 126824314
N-(3-fluorophenyl)-3-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]propanamide
CID 46560016
3-[4-(dimethylamino)-4-methylpiperidin-1-yl]-N-(3-fluorophenyl)propanamide
CID 126830524
N-(3-fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide;oxalic acid
CID 171154645
N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide
CID 63248996
N-(3-fluorophenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]acetamide
CID 4824691
N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide
CID 43065834
3-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]-N-(3-fluorophenyl)propanamide
CID 78896184
N-(3-fluorophenyl)-3-[4-(4-methylbenzoyl)piperidin-1-yl]propanamide
CID 55864910
N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 62736577

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide (CID 33363762) is N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide is O=C(CCN1CCN(S(=O)(=O)N2CCCC2)CC1)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide?
The InChIKey is UTSTYENTLJCXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN4O3S/c18-15-4-3-5-16(14-15)19-17(23)6-9-20-10-12-22(13-11-20)26(24,25)21-7-1-2-8-21/h3-5,14H,1-2,6-13H2,(H,19,23).
What are the key properties of N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide?
N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide has a molecular weight of 384.48 g/mol, XLogP of 1.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide is sourced from PubChem (CID 33363762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).