N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide

C13H20N6O3S — CID 166394145

IUPACN-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide
SMILESNS(=O)(=O)N1CC(C(=O)Nc2ccc(N3CCNCC3)cn2)C1
InChIInChI=1S/C13H20N6O3S/c14-23(21,22)19-8-10(9-19)13(20)17-12-2-1-11(7-16-12)18-5-3-15-4-6-18/h1-2,7,10,15H,3-6,8-9H2,(H2,14,21,22)(H,16,17,20)
InChIKeyLODMHJTULPPWRE-UHFFFAOYSA-N
MW340.41 g/mol
LogP-1.43
Rot. Bonds4

About N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide

N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide (PubChem CID 166394145) has the molecular formula C13H20N6O3S and a molecular weight of 340.41 g/mol. Its IUPAC name is N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide
PubChem CID166394145
Molecular FormulaC13H20N6O3S
Molecular Weight340.41 g/mol
Exact Mass340.13
IUPAC NameN-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide
SMILESNS(=O)(=O)N1CC(C(=O)Nc2ccc(N3CCNCC3)cn2)C1
InChIInChI=1S/C13H20N6O3S/c14-23(21,22)19-8-10(9-19)13(20)17-12-2-1-11(7-16-12)18-5-3-15-4-6-18/h1-2,7,10,15H,3-6,8-9H2,(H2,14,21,22)(H,16,17,20)
InChIKeyLODMHJTULPPWRE-UHFFFAOYSA-N
XLogP-1.43
TPSA120.66 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 5-1.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-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

2-chloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
CID 119494622
(2S)-5-oxo-N-(5-piperazin-1-yl-2-pyridinyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119494514
N-[5-(azepan-1-yl)-2-pyridinyl]cyclobutanecarboxamide
CID 113031088
N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide
CID 119494181
6-methyl-N-(5-piperazin-1-yl-2-pyridinyl)pyridine-3-carboxamide;dihydrochloride
CID 119494408
2-cyclopentyl-N-(5-piperazin-1-yl-2-pyridinyl)acetamide
CID 119260362
N-(5-morpholin-4-yl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 119842040
N-[5-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-pyridinyl]cyclopropanecarboxamide
CID 75420475
1-methyl-N-(5-piperazin-1-yl-2-pyridinyl)cyclopropane-1-carboxamide;hydrochloride
CID 119494178
3,4-dichloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494091
N-(5-piperazin-1-yl-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 119494479
N-(5-piperazin-1-yl-2-pyridinyl)-4-(trifluoromethyl)benzamide;hydrochloride
CID 119494136

Frequently Asked Questions

What is the IUPAC name of N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide?
The IUPAC name of N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide (CID 166394145) is N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide.
What is the SMILES notation for N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide?
The canonical SMILES for N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide is NS(=O)(=O)N1CC(C(=O)Nc2ccc(N3CCNCC3)cn2)C1.
What is the InChIKey of N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide?
The InChIKey is LODMHJTULPPWRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O3S/c14-23(21,22)19-8-10(9-19)13(20)17-12-2-1-11(7-16-12)18-5-3-15-4-6-18/h1-2,7,10,15H,3-6,8-9H2,(H2,14,21,22)(H,16,17,20).
What are the key properties of N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide?
N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide has a molecular weight of 340.41 g/mol, XLogP of -1.43, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide is sourced from PubChem (CID 166394145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).