1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride

C4H11ClN2O2S — CID 126841175

IUPAC1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride
SMILESCl.NCC1(S(N)(=O)=O)CC1
InChIInChI=1S/C4H10N2O2S.ClH/c5-3-4(1-2-4)9(6,7)8;/h1-3,5H2,(H2,6,7,8);1H
InChIKeyGXENGNIKPUFNFQ-UHFFFAOYSA-N
MW186.66 g/mol
LogP-0.81
Rot. Bonds2

About 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride

1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride (PubChem CID 126841175) has the molecular formula C4H11ClN2O2S and a molecular weight of 186.66 g/mol. Its IUPAC name is 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride
PubChem CID126841175
Molecular FormulaC4H11ClN2O2S
Molecular Weight186.66 g/mol
Exact Mass186.02
IUPAC Name1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride
SMILESCl.NCC1(S(N)(=O)=O)CC1
InChIInChI=1S/C4H10N2O2S.ClH/c5-3-4(1-2-4)9(6,7)8;/h1-3,5H2,(H2,6,7,8);1H
InChIKeyGXENGNIKPUFNFQ-UHFFFAOYSA-N
XLogP-0.81
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.66
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride?
The IUPAC name of 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride (CID 126841175) is 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride.
What is the SMILES notation for 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride?
The canonical SMILES for 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride is Cl.NCC1(S(N)(=O)=O)CC1.
What is the InChIKey of 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride?
The InChIKey is GXENGNIKPUFNFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2S.ClH/c5-3-4(1-2-4)9(6,7)8;/h1-3,5H2,(H2,6,7,8);1H.
What are the key properties of 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride?
1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride has a molecular weight of 186.66 g/mol, XLogP of -0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)cyclopropane-1-sulfonamide;hydrochloride is sourced from PubChem (CID 126841175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).