1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride

C9H19ClN2O2S — CID 138986730

IUPAC1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride
SMILESCl.NS(=O)(=O)C1(CN2CCCCC2)CC1
InChIInChI=1S/C9H18N2O2S.ClH/c10-14(12,13)9(4-5-9)8-11-6-2-1-3-7-11;/h1-8H2,(H2,10,12,13);1H
InChIKeySKBONMPZPTYKPX-UHFFFAOYSA-N
MW254.78 g/mol
LogP0.72
Rot. Bonds3

About 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride

1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride (PubChem CID 138986730) has the molecular formula C9H19ClN2O2S and a molecular weight of 254.78 g/mol. Its IUPAC name is 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride
PubChem CID138986730
Molecular FormulaC9H19ClN2O2S
Molecular Weight254.78 g/mol
Exact Mass254.09
IUPAC Name1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride
SMILESCl.NS(=O)(=O)C1(CN2CCCCC2)CC1
InChIInChI=1S/C9H18N2O2S.ClH/c10-14(12,13)9(4-5-9)8-11-6-2-1-3-7-11;/h1-8H2,(H2,10,12,13);1H
InChIKeySKBONMPZPTYKPX-UHFFFAOYSA-N
XLogP0.72
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.78
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride?
The IUPAC name of 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride (CID 138986730) is 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride.
What is the SMILES notation for 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride?
The canonical SMILES for 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride is Cl.NS(=O)(=O)C1(CN2CCCCC2)CC1.
What is the InChIKey of 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride?
The InChIKey is SKBONMPZPTYKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2S.ClH/c10-14(12,13)9(4-5-9)8-11-6-2-1-3-7-11;/h1-8H2,(H2,10,12,13);1H.
What are the key properties of 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride?
1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride has a molecular weight of 254.78 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-1-ylmethyl)cyclopropane-1-sulfonamide;hydrochloride is sourced from PubChem (CID 138986730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).