N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide

C11H20N2O2S — CID 174644155

IUPACN-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide
SMILESC=CCS(=O)(=O)N(C1CCNCC1)C1CC1
InChIInChI=1S/C11H20N2O2S/c1-2-9-16(14,15)13(10-3-4-10)11-5-7-12-8-6-11/h2,10-12H,1,3-9H2
InChIKeyNRMBCTAUKAEAIK-UHFFFAOYSA-N
MW244.36 g/mol
LogP0.72
Rot. Bonds5

About N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide

N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide (PubChem CID 174644155) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide
PubChem CID174644155
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC NameN-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide
SMILESC=CCS(=O)(=O)N(C1CCNCC1)C1CC1
InChIInChI=1S/C11H20N2O2S/c1-2-9-16(14,15)13(10-3-4-10)11-5-7-12-8-6-11/h2,10-12H,1,3-9H2
InChIKeyNRMBCTAUKAEAIK-UHFFFAOYSA-N
XLogP0.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(piperidin-4-yl)cyclopropanesulfonamide hydrochloride
CID 70895832
1-(Cyclopropylsulfonyl)piperidin-4-amine
CID 60145910
N-ethyl-N-(piperidin-4-yl)cyclopropanesulfonamide hydrochloride
CID 145884720
N-Ethyl-N-(piperidin-4-yl)cyclopropanesulfonamide
CID 64553903
N-(piperidin-4-yl)cyclopropanesulfonamide
CID 45496796
N-methyl-N-(piperidin-4-yl)cyclopropanesulfonamide
CID 57550885
1-(Cyclopropylsulfonyl)piperidin-4-amine hydrochloride
CID 60145909
N-Cyclopropyl-4-piperidinesulfonamide
CID 61545915
1-cyclopropylsulfonyl-N-methylpiperidin-4-amine
CID 64555323
N-(3-piperidin-1-ylsulfonylpropyl)cyclopropanamine
CID 65746236
2-Amino-ethanesulfonic acid (1-cyclopropyl-piperidin-4-yl)-amide
CID 66624632
2-piperidin-4-yl-5H-1,2-thiazole 1,1-dioxide
CID 68680143

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide?
The IUPAC name of N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide (CID 174644155) is N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide is C=CCS(=O)(=O)N(C1CCNCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide?
The InChIKey is NRMBCTAUKAEAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c1-2-9-16(14,15)13(10-3-4-10)11-5-7-12-8-6-11/h2,10-12H,1,3-9H2.
What are the key properties of N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide?
N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide has a molecular weight of 244.36 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-piperidin-4-ylprop-2-ene-1-sulfonamide is sourced from PubChem (CID 174644155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).