biphenylene;sulfamide

C12H12N2O2S — CID 67882419

IUPACbiphenylene;sulfamide
SMILESNS(N)(=O)=O.c1ccc2c(c1)-c1ccccc1-2
InChIInChI=1S/C12H8.H4N2O2S/c1-2-6-10-9(5-1)11-7-3-4-8-12(10)11;1-5(2,3)4/h1-8H;(H4,1,2,3,4)
InChIKeySKCVVGOHOKFPFS-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.48
Rot. Bonds

About biphenylene;sulfamide

biphenylene;sulfamide (PubChem CID 67882419) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is biphenylene;sulfamide.

Molecular Properties

Compound Namebiphenylene;sulfamide
PubChem CID67882419
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Namebiphenylene;sulfamide
SMILESNS(N)(=O)=O.c1ccc2c(c1)-c1ccccc1-2
InChIInChI=1S/C12H8.H4N2O2S/c1-2-6-10-9(5-1)11-7-3-4-8-12(10)11;1-5(2,3)4/h1-8H;(H4,1,2,3,4)
InChIKeySKCVVGOHOKFPFS-UHFFFAOYSA-N
XLogP1.48
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Biphenylene
CID 9214
1-Biphenylenylboronic acid
CID 2795479
1,2,3,4,4a,8b-Hexahydrobiphenylene
CID 15140078
Acetylene;biphenylene
CID 18175768
Biphenylen-1-ylphosphonous acid
CID 18414832
Azane;1,1'-biphenyl;sulfamic acid
CID 19359078
Azane;biphenylene
CID 21257460
CID 21297480
CID 21297480
Azane;biphenylene
CID 21885959
Biphenylene;sulfane
CID 21938779
Biphenylene;methane
CID 22235154
1-Iodosyl-4-phenylbenzene;sulfamide
CID 23357579

Frequently Asked Questions

What is the IUPAC name of biphenylene;sulfamide?
The IUPAC name of biphenylene;sulfamide (CID 67882419) is biphenylene;sulfamide.
What is the SMILES notation for biphenylene;sulfamide?
The canonical SMILES for biphenylene;sulfamide is NS(N)(=O)=O.c1ccc2c(c1)-c1ccccc1-2.
What is the InChIKey of biphenylene;sulfamide?
The InChIKey is SKCVVGOHOKFPFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8.H4N2O2S/c1-2-6-10-9(5-1)11-7-3-4-8-12(10)11;1-5(2,3)4/h1-8H;(H4,1,2,3,4).
What are the key properties of biphenylene;sulfamide?
biphenylene;sulfamide has a molecular weight of 248.31 g/mol, XLogP of 1.48, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for biphenylene;sulfamide is sourced from PubChem (CID 67882419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).