N-(3-methyltriazol-4-yl)cyclopropanesulfonamide

C6H10N4O2S — CID 130666164

IUPACN-(3-methyltriazol-4-yl)cyclopropanesulfonamide
SMILESCn1nncc1NS(=O)(=O)C1CC1
InChIInChI=1S/C6H10N4O2S/c1-10-6(4-7-9-10)8-13(11,12)5-2-3-5/h4-5,8H,2-3H2,1H3
InChIKeyLKECVCCBQPEVPH-UHFFFAOYSA-N
MW202.24 g/mol
LogP-0.28
Rot. Bonds3

About N-(3-methyltriazol-4-yl)cyclopropanesulfonamide

N-(3-methyltriazol-4-yl)cyclopropanesulfonamide (PubChem CID 130666164) has the molecular formula C6H10N4O2S and a molecular weight of 202.24 g/mol. Its IUPAC name is N-(3-methyltriazol-4-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(3-methyltriazol-4-yl)cyclopropanesulfonamide
PubChem CID130666164
Molecular FormulaC6H10N4O2S
Molecular Weight202.24 g/mol
Exact Mass202.05
IUPAC NameN-(3-methyltriazol-4-yl)cyclopropanesulfonamide
SMILESCn1nncc1NS(=O)(=O)C1CC1
InChIInChI=1S/C6H10N4O2S/c1-10-6(4-7-9-10)8-13(11,12)5-2-3-5/h4-5,8H,2-3H2,1H3
InChIKeyLKECVCCBQPEVPH-UHFFFAOYSA-N
XLogP-0.28
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyltriazol-4-yl)cyclopropanesulfonamide?
The IUPAC name of N-(3-methyltriazol-4-yl)cyclopropanesulfonamide (CID 130666164) is N-(3-methyltriazol-4-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(3-methyltriazol-4-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(3-methyltriazol-4-yl)cyclopropanesulfonamide is Cn1nncc1NS(=O)(=O)C1CC1.
What is the InChIKey of N-(3-methyltriazol-4-yl)cyclopropanesulfonamide?
The InChIKey is LKECVCCBQPEVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2S/c1-10-6(4-7-9-10)8-13(11,12)5-2-3-5/h4-5,8H,2-3H2,1H3.
What are the key properties of N-(3-methyltriazol-4-yl)cyclopropanesulfonamide?
N-(3-methyltriazol-4-yl)cyclopropanesulfonamide has a molecular weight of 202.24 g/mol, XLogP of -0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyltriazol-4-yl)cyclopropanesulfonamide is sourced from PubChem (CID 130666164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).