N-methyl-N-(phenylsulfonimidoyl)methanamine

C8H12N2OS — CID 12509544

IUPACN-methyl-N-(phenylsulfonimidoyl)methanamine
SMILES[H]N=S(=O)(c1ccccc1)N(C)C
InChIInChI=1S/C8H12N2OS/c1-10(2)12(9,11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyGBYIDZXKVPVBPS-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.57
Rot. Bonds2

About N-methyl-N-(phenylsulfonimidoyl)methanamine

N-methyl-N-(phenylsulfonimidoyl)methanamine (PubChem CID 12509544) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is N-methyl-N-(phenylsulfonimidoyl)methanamine.

Molecular Properties

Compound NameN-methyl-N-(phenylsulfonimidoyl)methanamine
PubChem CID12509544
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC NameN-methyl-N-(phenylsulfonimidoyl)methanamine
SMILES[H]N=S(=O)(c1ccccc1)N(C)C
InChIInChI=1S/C8H12N2OS/c1-10(2)12(9,11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyGBYIDZXKVPVBPS-UHFFFAOYSA-N
XLogP1.57
TPSA44.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(phenylsulfonimidoyl)methanamine?
The IUPAC name of N-methyl-N-(phenylsulfonimidoyl)methanamine (CID 12509544) is N-methyl-N-(phenylsulfonimidoyl)methanamine.
What is the SMILES notation for N-methyl-N-(phenylsulfonimidoyl)methanamine?
The canonical SMILES for N-methyl-N-(phenylsulfonimidoyl)methanamine is [H]N=S(=O)(c1ccccc1)N(C)C.
What is the InChIKey of N-methyl-N-(phenylsulfonimidoyl)methanamine?
The InChIKey is GBYIDZXKVPVBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-10(2)12(9,11)8-6-4-3-5-7-8/h3-7,9H,1-2H3.
What are the key properties of N-methyl-N-(phenylsulfonimidoyl)methanamine?
N-methyl-N-(phenylsulfonimidoyl)methanamine has a molecular weight of 184.26 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(phenylsulfonimidoyl)methanamine is sourced from PubChem (CID 12509544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).