N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide

C17H26N4O4S — CID 48938077

IUPACN-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide
SMILESCCNC(=O)C1CCCN(C(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)C1
InChIInChI=1S/C17H26N4O4S/c1-3-19-17(23)13-5-4-10-21(11-13)12(2)16(22)20-14-6-8-15(9-7-14)26(18,24)25/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,19,23)(H,20,22)(H2,18,24,25)
InChIKeyLVMYWZWTPUZRPX-UHFFFAOYSA-N
MW382.49 g/mol
LogP0.51
Rot. Bonds6

About N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide

N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide (PubChem CID 48938077) has the molecular formula C17H26N4O4S and a molecular weight of 382.49 g/mol. Its IUPAC name is N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide
PubChem CID48938077
Molecular FormulaC17H26N4O4S
Molecular Weight382.49 g/mol
Exact Mass382.17
IUPAC NameN-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide
SMILESCCNC(=O)C1CCCN(C(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)C1
InChIInChI=1S/C17H26N4O4S/c1-3-19-17(23)13-5-4-10-21(11-13)12(2)16(22)20-14-6-8-15(9-7-14)26(18,24)25/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,19,23)(H,20,22)(H2,18,24,25)
InChIKeyLVMYWZWTPUZRPX-UHFFFAOYSA-N
XLogP0.51
TPSA121.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-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

(3S)-1-[(2S)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 51672985
2-[3-(methylamino)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide;hydrochloride
CID 119918352
(2R)-2-[(3S)-3-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide
CID 98794961
(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide
CID 41331851
ethyl (3S)-1-[(2R)-1-oxo-1-[4-(trifluoromethyl)anilino]propan-2-yl]piperidine-3-carboxylate
CID 98764431
1-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]-N-ethylpiperidine-3-carboxamide
CID 48937654
(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
CID 670213
2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119918280
(3S)-1-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 51500739
1-(4-methylphenyl)sulfonyl-N-(4-sulfamoylphenyl)piperidine-3-carboxamide
CID 16863432
1-N-[(2S)-pentan-2-yl]-4-N-(4-sulfamoylphenyl)piperidine-1,4-dicarboxamide
CID 41134383
ethyl (3R)-1-[(4-sulfamoylphenyl)carbamothioyl]piperidine-3-carboxylate
CID 1289838

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide?
The IUPAC name of N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide (CID 48938077) is N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide?
The canonical SMILES for N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide is CCNC(=O)C1CCCN(C(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)C1.
What is the InChIKey of N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide?
The InChIKey is LVMYWZWTPUZRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O4S/c1-3-19-17(23)13-5-4-10-21(11-13)12(2)16(22)20-14-6-8-15(9-7-14)26(18,24)25/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,19,23)(H,20,22)(H2,18,24,25).
What are the key properties of N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide?
N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide has a molecular weight of 382.49 g/mol, XLogP of 0.51, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 48938077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).