N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride

C15H26ClN3O2S2 — CID 146065101

IUPACN-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(c1cccs1)N(CCN1CCCCC1)C1CCNC1
InChIInChI=1S/C15H25N3O2S2.ClH/c19-22(20,15-5-4-12-21-15)18(14-6-7-16-13-14)11-10-17-8-2-1-3-9-17;/h4-5,12,14,16H,1-3,6-11,13H2;1H
InChIKeyTUPYXBFMGONNGK-UHFFFAOYSA-N
MW379.98 g/mol
LogP2.01
Rot. Bonds6

About N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride

N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride (PubChem CID 146065101) has the molecular formula C15H26ClN3O2S2 and a molecular weight of 379.98 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride
PubChem CID146065101
Molecular FormulaC15H26ClN3O2S2
Molecular Weight379.98 g/mol
Exact Mass379.12
IUPAC NameN-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(c1cccs1)N(CCN1CCCCC1)C1CCNC1
InChIInChI=1S/C15H25N3O2S2.ClH/c19-22(20,15-5-4-12-21-15)18(14-6-7-16-13-14)11-10-17-8-2-1-3-9-17;/h4-5,12,14,16H,1-3,6-11,13H2;1H
InChIKeyTUPYXBFMGONNGK-UHFFFAOYSA-N
XLogP2.01
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.98
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-propyl-N-[(3S)-pyrrolidin-3-yl]thiophene-2-sulfonamide
CID 95395150
N-ethyl-N-pyrrolidin-3-ylthiophene-2-sulfonamide
CID 63299353
N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylquinoline-8-sulfonamide;hydrochloride
CID 146065089
4-ethoxy-N-pyrrolidin-3-yl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;hydrochloride
CID 146065088
3-fluoro-N-piperidin-3-yl-N-(2-piperidin-1-ylethyl)benzenesulfonamide;hydrochloride
CID 146065125
N-methyl-N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide;hydrochloride
CID 71640930
N-(2-oxo-2-piperazin-1-ylethyl)-N-(2-piperidin-1-ylethyl)thiophene-2-sulfonamide
CID 20934420
N-methyl-N-[(3S)-piperidin-3-yl]thiophene-2-sulfonamide
CID 71641141
2-[piperidin-4-yl(thiophen-2-ylsulfonyl)amino]acetamide
CID 60802279
5-methyl-N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 146071644
N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
CID 43577528
N,N-dicyclohexylthiophene-2-sulfonamide
CID 19682432

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride?
The IUPAC name of N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride (CID 146065101) is N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride is Cl.O=S(=O)(c1cccs1)N(CCN1CCCCC1)C1CCNC1.
What is the InChIKey of N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride?
The InChIKey is TUPYXBFMGONNGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S2.ClH/c19-22(20,15-5-4-12-21-15)18(14-6-7-16-13-14)11-10-17-8-2-1-3-9-17;/h4-5,12,14,16H,1-3,6-11,13H2;1H.
What are the key properties of N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride?
N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride has a molecular weight of 379.98 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)-N-pyrrolidin-3-ylthiophene-2-sulfonamide;hydrochloride is sourced from PubChem (CID 146065101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).