4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide

C18H36N4O3S — CID 86984564

IUPAC4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide
SMILESCCCS(=O)(=O)NC1CCN(C(=O)NC2CC(C)(C)NC(C)(C)C2)CC1
InChIInChI=1S/C18H36N4O3S/c1-6-11-26(24,25)20-14-7-9-22(10-8-14)16(23)19-15-12-17(2,3)21-18(4,5)13-15/h14-15,20-21H,6-13H2,1-5H3,(H,19,23)
InChIKeyBGYMXIPJCOPIMN-UHFFFAOYSA-N
MW388.58 g/mol
LogP1.80
Rot. Bonds5

About 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide

4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide (PubChem CID 86984564) has the molecular formula C18H36N4O3S and a molecular weight of 388.58 g/mol. Its IUPAC name is 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide
PubChem CID86984564
Molecular FormulaC18H36N4O3S
Molecular Weight388.58 g/mol
Exact Mass388.25
IUPAC Name4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide
SMILESCCCS(=O)(=O)NC1CCN(C(=O)NC2CC(C)(C)NC(C)(C)C2)CC1
InChIInChI=1S/C18H36N4O3S/c1-6-11-26(24,25)20-14-7-9-22(10-8-14)16(23)19-15-12-17(2,3)21-18(4,5)13-15/h14-15,20-21H,6-13H2,1-5H3,(H,19,23)
InChIKeyBGYMXIPJCOPIMN-UHFFFAOYSA-N
XLogP1.80
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.58
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-3-methyl-N-(1-propylsulfonylpiperidin-4-yl)piperidine-1-carboxamide
CID 137835102
N-[4-(2,4-dimethyl-1-oxo-1,4-thiazinan-2-yl)-2-methylbutan-2-yl]-4-methyl-3-[(propan-2-ylamino)methyl]piperazine-1-carboxamide
CID 123399017
4-[(1-Ethylsulfonylpiperidin-4-yl)amino]piperidine-1-carboxamide
CID 43771746
4-methylsulfonyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperazine-1-carboxamide
CID 45829774
1-(1-Methylsulfonylpiperidin-3-yl)-3-(2,2,6,6-tetramethylpiperidin-4-yl)urea
CID 47765803
1-[2-(3-Methylpiperidin-1-yl)propyl]-3-(1-methylsulfonylpiperidin-3-yl)urea
CID 47765989
2-(cyclohexylmethyl)-N-(1-ethylsulfonylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 48956253
2-(2,2-dimethylpropyl)-N-(1-ethylsulfonylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 49123019
4-ethylsulfonyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperazine-1-carboxamide
CID 49633599
4-ethylsulfonyl-N-(2-methyl-2-piperidin-1-ylpropyl)piperazine-1-carboxamide
CID 49633831
4-ethylsulfonyl-N-[1-(2-methylpropyl)piperidin-4-yl]piperazine-1-carboxamide
CID 49634508
4-ethylsulfonyl-N-[2-(3-methylpiperidin-1-yl)propyl]piperazine-1-carboxamide
CID 49634994

Frequently Asked Questions

What is the IUPAC name of 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide (CID 86984564) is 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide is CCCS(=O)(=O)NC1CCN(C(=O)NC2CC(C)(C)NC(C)(C)C2)CC1.
What is the InChIKey of 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide?
The InChIKey is BGYMXIPJCOPIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N4O3S/c1-6-11-26(24,25)20-14-7-9-22(10-8-14)16(23)19-15-12-17(2,3)21-18(4,5)13-15/h14-15,20-21H,6-13H2,1-5H3,(H,19,23).
What are the key properties of 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide?
4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide has a molecular weight of 388.58 g/mol, XLogP of 1.80, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 86984564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).