N-(1-methyltetrazol-5-yl)propane-2-sulfonamide

C5H11N5O2S — CID 164745594

IUPACN-(1-methyltetrazol-5-yl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1nnnn1C
InChIInChI=1S/C5H11N5O2S/c1-4(2)13(11,12)7-5-6-8-9-10(5)3/h4H,1-3H3,(H,6,7,9)
InChIKeySVLODDOSWNEAOY-UHFFFAOYSA-N
MW205.24 g/mol
LogP-0.64
Rot. Bonds3

About N-(1-methyltetrazol-5-yl)propane-2-sulfonamide

N-(1-methyltetrazol-5-yl)propane-2-sulfonamide (PubChem CID 164745594) has the molecular formula C5H11N5O2S and a molecular weight of 205.24 g/mol. Its IUPAC name is N-(1-methyltetrazol-5-yl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(1-methyltetrazol-5-yl)propane-2-sulfonamide
PubChem CID164745594
Molecular FormulaC5H11N5O2S
Molecular Weight205.24 g/mol
Exact Mass205.06
IUPAC NameN-(1-methyltetrazol-5-yl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1nnnn1C
InChIInChI=1S/C5H11N5O2S/c1-4(2)13(11,12)7-5-6-8-9-10(5)3/h4H,1-3H3,(H,6,7,9)
InChIKeySVLODDOSWNEAOY-UHFFFAOYSA-N
XLogP-0.64
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 5-0.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyltetrazol-5-yl)propane-2-sulfonamide?
The IUPAC name of N-(1-methyltetrazol-5-yl)propane-2-sulfonamide (CID 164745594) is N-(1-methyltetrazol-5-yl)propane-2-sulfonamide.
What is the SMILES notation for N-(1-methyltetrazol-5-yl)propane-2-sulfonamide?
The canonical SMILES for N-(1-methyltetrazol-5-yl)propane-2-sulfonamide is CC(C)S(=O)(=O)Nc1nnnn1C.
What is the InChIKey of N-(1-methyltetrazol-5-yl)propane-2-sulfonamide?
The InChIKey is SVLODDOSWNEAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N5O2S/c1-4(2)13(11,12)7-5-6-8-9-10(5)3/h4H,1-3H3,(H,6,7,9).
What are the key properties of N-(1-methyltetrazol-5-yl)propane-2-sulfonamide?
N-(1-methyltetrazol-5-yl)propane-2-sulfonamide has a molecular weight of 205.24 g/mol, XLogP of -0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyltetrazol-5-yl)propane-2-sulfonamide is sourced from PubChem (CID 164745594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).