[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride

C10H17ClN2O3S — CID 120874730

IUPAC[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
SMILESCl.NCC1CCCCN1S(=O)(=O)c1ccco1
InChIInChI=1S/C10H16N2O3S.ClH/c11-8-9-4-1-2-6-12(9)16(13,14)10-5-3-7-15-10;/h3,5,7,9H,1-2,4,6,8,11H2;1H
InChIKeyVWGNDSKXINCKHX-UHFFFAOYSA-N
MW280.78 g/mol
LogP1.20
Rot. Bonds3

About [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride

[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride (PubChem CID 120874730) has the molecular formula C10H17ClN2O3S and a molecular weight of 280.78 g/mol. Its IUPAC name is [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride.

Molecular Properties

Compound Name[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
PubChem CID120874730
Molecular FormulaC10H17ClN2O3S
Molecular Weight280.78 g/mol
Exact Mass280.06
IUPAC Name[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
SMILESCl.NCC1CCCCN1S(=O)(=O)c1ccco1
InChIInChI=1S/C10H16N2O3S.ClH/c11-8-9-4-1-2-6-12(9)16(13,14)10-5-3-7-15-10;/h3,5,7,9H,1-2,4,6,8,11H2;1H
InChIKeyVWGNDSKXINCKHX-UHFFFAOYSA-N
XLogP1.20
TPSA76.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.78
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(furan-2-ylsulfonyl)pyrrolidin-2-yl]methanamine;hydrochloride
CID 120875357
[1-(3-methylsulfonylphenyl)sulfonylpiperidin-2-yl]methanamine;hydrochloride
CID 119969590
[1-(2,4,6-trifluorophenyl)sulfonylpiperidin-2-yl]methanamine;hydrochloride
CID 119969331
[(2R)-1-(3-methylpyrazin-2-yl)sulfonylpiperidin-2-yl]methanamine
CID 97162685
[(2R)-1-(4-ethylsulfonylphenyl)sulfonylpiperidin-2-yl]methanamine
CID 124684733
1-(furan-2-ylsulfonyl)pyrrolidine
CID 130723774
[1-(2,4,5-trifluorophenyl)sulfonylpiperidin-2-yl]methanamine;hydrochloride
CID 119969346
4-[2-(aminomethyl)piperidin-1-yl]sulfonyl-N,N-dimethylbenzamide;hydrochloride
CID 120707986
[1-(2,4-difluorophenyl)sulfonylpiperidin-2-yl]methanamine;hydrochloride
CID 119969239
[1-(4-methylsulfonylphenyl)sulfonylpyrrolidin-2-yl]methanamine;hydrochloride
CID 119988752
5-[2-(aminomethyl)piperidin-1-yl]sulfonyl-2-methylisoindole-1,3-dione;hydrochloride
CID 119969518
2-[(2R)-2-(aminomethyl)piperidin-1-yl]sulfonylpyridine-4-carbonitrile
CID 97165435

Frequently Asked Questions

What is the IUPAC name of [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride?
The IUPAC name of [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride (CID 120874730) is [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride.
What is the SMILES notation for [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride?
The canonical SMILES for [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride is Cl.NCC1CCCCN1S(=O)(=O)c1ccco1.
What is the InChIKey of [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride?
The InChIKey is VWGNDSKXINCKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S.ClH/c11-8-9-4-1-2-6-12(9)16(13,14)10-5-3-7-15-10;/h3,5,7,9H,1-2,4,6,8,11H2;1H.
What are the key properties of [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride?
[1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride has a molecular weight of 280.78 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(furan-2-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride is sourced from PubChem (CID 120874730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).