N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide

C18H22N4O4S — CID 171141731

IUPACN-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide
SMILESCc1noc(C2CCN(S(=O)(=O)c3ccccc3)CC2NC(=O)C2CC2)n1
InChIInChI=1S/C18H22N4O4S/c1-12-19-18(26-21-12)15-9-10-22(11-16(15)20-17(23)13-7-8-13)27(24,25)14-5-3-2-4-6-14/h2-6,13,15-16H,7-11H2,1H3,(H,20,23)
InChIKeyBBWNSFIMNXIJAI-UHFFFAOYSA-N
MW390.47 g/mol
LogP1.45
Rot. Bonds5

About N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide

N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide (PubChem CID 171141731) has the molecular formula C18H22N4O4S and a molecular weight of 390.47 g/mol. Its IUPAC name is N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide
PubChem CID171141731
Molecular FormulaC18H22N4O4S
Molecular Weight390.47 g/mol
Exact Mass390.14
IUPAC NameN-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide
SMILESCc1noc(C2CCN(S(=O)(=O)c3ccccc3)CC2NC(=O)C2CC2)n1
InChIInChI=1S/C18H22N4O4S/c1-12-19-18(26-21-12)15-9-10-22(11-16(15)20-17(23)13-7-8-13)27(24,25)14-5-3-2-4-6-14/h2-6,13,15-16H,7-11H2,1H3,(H,20,23)
InChIKeyBBWNSFIMNXIJAI-UHFFFAOYSA-N
XLogP1.45
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.47
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide 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-methoxy-N-[(3S,4S)-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1-methylsulfonylpiperidin-3-yl]acetamide
CID 91915749
1-(benzenesulfonyl)-N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]piperidine-4-carboxamide
CID 100644384
1-(benzenesulfonyl)-N-(2-bicyclo[2.2.1]heptanyl)piperidine-4-carboxamide
CID 131956185
1-(benzenesulfonyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperidine-3-carboxamide
CID 55765498
(3S)-1-(benzenesulfonyl)-N-cycloheptylpiperidine-3-carboxamide
CID 39898448
N-[(1R,2R)-2-benzamidocyclohexyl]-1-(benzenesulfonyl)piperidine-4-carboxamide
CID 51071212
1-(benzenesulfonyl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide
CID 8831496
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 56724154
N-[2-(aminomethyl)cyclopentyl]-1-(benzenesulfonyl)piperidine-3-carboxamide
CID 119603072
[4-(benzenesulfonyl)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)piperazin-1-yl]-cyclopropylmethanone
CID 44783720
1-(benzenesulfonyl)-N-propan-2-ylpiperidine-3-carboxamide
CID 51179844
1-(benzenesulfonyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 6498125

Frequently Asked Questions

What is the IUPAC name of N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide (CID 171141731) is N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide is Cc1noc(C2CCN(S(=O)(=O)c3ccccc3)CC2NC(=O)C2CC2)n1.
What is the InChIKey of N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide?
The InChIKey is BBWNSFIMNXIJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4S/c1-12-19-18(26-21-12)15-9-10-22(11-16(15)20-17(23)13-7-8-13)27(24,25)14-5-3-2-4-6-14/h2-6,13,15-16H,7-11H2,1H3,(H,20,23).
What are the key properties of N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide?
N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide has a molecular weight of 390.47 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(benzenesulfonyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 171141731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).