N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide

C11H20N2O3S — CID 3497697

IUPACN-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide
SMILESCCS(=O)(=O)N1CCCC(C(=O)NC2CC2)C1
InChIInChI=1S/C11H20N2O3S/c1-2-17(15,16)13-7-3-4-9(8-13)11(14)12-10-5-6-10/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyROSINGKFMYWBEW-UHFFFAOYSA-N
MW260.36 g/mol
LogP0.33
Rot. Bonds4

About N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide

N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide (PubChem CID 3497697) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide
PubChem CID3497697
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC NameN-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide
SMILESCCS(=O)(=O)N1CCCC(C(=O)NC2CC2)C1
InChIInChI=1S/C11H20N2O3S/c1-2-17(15,16)13-7-3-4-9(8-13)11(14)12-10-5-6-10/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyROSINGKFMYWBEW-UHFFFAOYSA-N
XLogP0.33
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethylsulfonyl-N-(4-methylcyclohexyl)piperidine-3-carboxamide
CID 3238187
(3S)-N-cyclooctyl-1-ethylsulfonylpiperidine-3-carboxamide
CID 41447237
(3S)-N-cyclopentyl-1-methylsulfonylpiperidine-3-carboxamide
CID 6938499
N-(4-hydroxycyclohexyl)-1-methylsulfonylpiperidine-3-carboxamide
CID 43417208
(3R)-N-cyclopentyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 92686253
1-[(1-ethylsulfonylpiperidine-3-carbonyl)amino]-3-propan-2-ylthiourea
CID 17126894
N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide
CID 126810680
(3S)-1-[(3-chlorophenyl)methylsulfonyl]-N-cyclopropylpiperidine-3-carboxamide
CID 92641774
(3R)-1-(4-bromophenyl)sulfonyl-N-cyclopropylpiperidine-3-carboxamide
CID 41302436
(3R)-1-ethylsulfonyl-N-(4-iodophenyl)piperidine-3-carboxamide
CID 41447084
(3R)-1-[(2-chlorophenyl)methylsulfonyl]-N-cyclohexylpiperidine-3-carboxamide
CID 92641524
(3S)-1-[(2-chlorophenyl)methylsulfonyl]-N-cyclohexylpiperidine-3-carboxamide
CID 92641525

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide (CID 3497697) is N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide is CCS(=O)(=O)N1CCCC(C(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide?
The InChIKey is ROSINGKFMYWBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-2-17(15,16)13-7-3-4-9(8-13)11(14)12-10-5-6-10/h9-10H,2-8H2,1H3,(H,12,14).
What are the key properties of N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide?
N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide has a molecular weight of 260.36 g/mol, XLogP of 0.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 3497697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).