N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide

C14H24N2O3S — CID 126810680

IUPACN-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide
SMILESCCS(=O)(=O)N1CCCC(C(=O)NC2(C3CC3)CC2)C1
InChIInChI=1S/C14H24N2O3S/c1-2-20(18,19)16-9-3-4-11(10-16)13(17)15-14(7-8-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,17)
InChIKeyMEVUHUHHDDLCDN-UHFFFAOYSA-N
MW300.42 g/mol
LogP1.11
Rot. Bonds5

About N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide

N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide (PubChem CID 126810680) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide
PubChem CID126810680
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC NameN-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide
SMILESCCS(=O)(=O)N1CCCC(C(=O)NC2(C3CC3)CC2)C1
InChIInChI=1S/C14H24N2O3S/c1-2-20(18,19)16-9-3-4-11(10-16)13(17)15-14(7-8-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,17)
InChIKeyMEVUHUHHDDLCDN-UHFFFAOYSA-N
XLogP1.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-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

N-cyclopropyl-1-ethylsulfonylpiperidine-3-carboxamide
CID 3497697
1-ethylsulfonyl-N-(4-methylcyclohexyl)piperidine-3-carboxamide
CID 3238187
(3S)-N-(1-adamantyl)-1-propylsulfonylpiperidine-3-carboxamide
CID 51941058
(3S)-N-cyclooctyl-1-ethylsulfonylpiperidine-3-carboxamide
CID 41447237
ethyl 1-[(1-propylsulfonylpiperidine-3-carbonyl)amino]cyclohexane-1-carboxylate
CID 55801599
1-[(1-ethylsulfonylpiperidine-3-carbonyl)amino]-3-propan-2-ylthiourea
CID 17126894
1-ethylsulfonyl-N'-hydroxypiperidine-3-carboximidamide
CID 77041761
(3R)-1-ethylsulfonyl-N-(4-iodophenyl)piperidine-3-carboxamide
CID 41447084
(3S)-N-[3-[(2S)-2-ethylpiperidin-1-yl]propyl]-1-ethylsulfonylpiperidine-3-carboxamide
CID 124757090
tert-butyl N-[2-[[(3R)-1-ethylsulfonylpiperidine-3-carbonyl]amino]ethyl]carbamate
CID 52508323
(3S)-1-ethylsulfonyl-N-[(2R)-2-methyl-3-pyrrolidin-1-ylpropyl]piperidine-3-carboxamide
CID 95875421
(3R)-1-ethylsulfonyl-N-[(2R)-2-methyl-3-pyrrolidin-1-ylpropyl]piperidine-3-carboxamide
CID 95875422

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide?
The IUPAC name of N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide (CID 126810680) is N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide is CCS(=O)(=O)N1CCCC(C(=O)NC2(C3CC3)CC2)C1.
What is the InChIKey of N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide?
The InChIKey is MEVUHUHHDDLCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-2-20(18,19)16-9-3-4-11(10-16)13(17)15-14(7-8-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,17).
What are the key properties of N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide?
N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide has a molecular weight of 300.42 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylcyclopropyl)-1-ethylsulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 126810680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).