N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide

C4H9N5O2S — CID 130618771

IUPACN-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide
SMILESCn1nnc(CNS(C)(=O)=O)n1
InChIInChI=1S/C4H9N5O2S/c1-9-7-4(6-8-9)3-5-12(2,10)11/h5H,3H2,1-2H3
InChIKeyVJUCMOZMVLMXFA-UHFFFAOYSA-N
MW191.22 g/mol
LogP-1.74
Rot. Bonds3

About N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide

N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide (PubChem CID 130618771) has the molecular formula C4H9N5O2S and a molecular weight of 191.22 g/mol. Its IUPAC name is N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide
PubChem CID130618771
Molecular FormulaC4H9N5O2S
Molecular Weight191.22 g/mol
Exact Mass191.05
IUPAC NameN-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide
SMILESCn1nnc(CNS(C)(=O)=O)n1
InChIInChI=1S/C4H9N5O2S/c1-9-7-4(6-8-9)3-5-12(2,10)11/h5H,3H2,1-2H3
InChIKeyVJUCMOZMVLMXFA-UHFFFAOYSA-N
XLogP-1.74
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 5-1.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[(2-methyltetrazol-5-yl)methylamino]ethyl]methanesulfonamide
CID 107042158
2-[(2-methyltetrazol-5-yl)methylamino]-N-propan-2-ylpropanamide
CID 107042657
2-ethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042740
4-(methanesulfonamido)-N-(2-methyltetrazol-5-yl)benzenesulfonamide
CID 167789221
2-cyclopropyl-2-[(2-methyltetrazol-5-yl)methylamino]acetic acid
CID 107044903
3-(2-methyltetrazol-5-yl)propanoic acid
CID 22069179
tert-butyl N-[(2-methyltetrazol-5-yl)methyl]carbamate
CID 45092164
3-amino-5-methylsulfonyl-1-(2-methyltetrazol-5-yl)pentan-2-one
CID 107061779
5-[(2-methyltetrazol-5-yl)methylamino]piperidin-2-one
CID 107042410
N-cyclopropyl-2-[(2-methyltetrazol-5-yl)methylamino]propanamide
CID 107042658
4-[(2-methyltetrazol-5-yl)methyl]azetidin-2-one
CID 10241164
2-bromo-N-[(2-methyltetrazol-5-yl)methyl]prop-2-en-1-amine
CID 107042685

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide?
The IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide (CID 130618771) is N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide?
The canonical SMILES for N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide is Cn1nnc(CNS(C)(=O)=O)n1.
What is the InChIKey of N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide?
The InChIKey is VJUCMOZMVLMXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N5O2S/c1-9-7-4(6-8-9)3-5-12(2,10)11/h5H,3H2,1-2H3.
What are the key properties of N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide?
N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide has a molecular weight of 191.22 g/mol, XLogP of -1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyltetrazol-5-yl)methyl]methanesulfonamide is sourced from PubChem (CID 130618771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).