biphenylene-1,2-dicarboxamide

C14H10N2O2 — CID 22057045

IUPACbiphenylene-1,2-dicarboxamide
SMILESNC(=O)c1ccc2c(c1C(N)=O)=c1ccccc1=2
InChIInChI=1S/C14H10N2O2/c15-13(17)10-6-5-9-7-3-1-2-4-8(7)11(9)12(10)14(16)18/h1-6H,(H2,15,17)(H2,16,18)
InChIKeyIZJXFQMRFRXZJB-UHFFFAOYSA-N
MW238.25 g/mol
LogP0.77
Rot. Bonds2

About biphenylene-1,2-dicarboxamide

biphenylene-1,2-dicarboxamide (PubChem CID 22057045) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is biphenylene-1,2-dicarboxamide.

Molecular Properties

Compound Namebiphenylene-1,2-dicarboxamide
PubChem CID22057045
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Namebiphenylene-1,2-dicarboxamide
SMILESNC(=O)c1ccc2c(c1C(N)=O)=c1ccccc1=2
InChIInChI=1S/C14H10N2O2/c15-13(17)10-6-5-9-7-3-1-2-4-8(7)11(9)12(10)14(16)18/h1-6H,(H2,15,17)(H2,16,18)
InChIKeyIZJXFQMRFRXZJB-UHFFFAOYSA-N
XLogP0.77
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

benzene-1,2,3,4-tetracarboxamide
CID 54274025
3,4-bis(sulfanyl)benzene-1,2-dicarboxamide
CID 141147444
CID 67588186
CID 67588186
benzene-1,2-dicarboxamide;hydrazine
CID 158131121
naphthalene-1,2-dicarboxamide;tetrazine
CID 175558272
2-sulfanyl-4-tritylbenzamide
CID 67328348
3-benzyl-4-ethenylbenzene-1,2-dicarboxamide
CID 174922883
acridine-1,2-dicarboxamide
CID 154155519
2,3-diaminobenzene-1,4-dicarboxamide
CID 142757766
2-oxaldehydoylbenzamide
CID 146295366
benzene;2-hydroxybenzamide
CID 157085280
2-methanimidoylbenzamide
CID 123272130

Frequently Asked Questions

What is the IUPAC name of biphenylene-1,2-dicarboxamide?
The IUPAC name of biphenylene-1,2-dicarboxamide (CID 22057045) is biphenylene-1,2-dicarboxamide.
What is the SMILES notation for biphenylene-1,2-dicarboxamide?
The canonical SMILES for biphenylene-1,2-dicarboxamide is NC(=O)c1ccc2c(c1C(N)=O)=c1ccccc1=2.
What is the InChIKey of biphenylene-1,2-dicarboxamide?
The InChIKey is IZJXFQMRFRXZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c15-13(17)10-6-5-9-7-3-1-2-4-8(7)11(9)12(10)14(16)18/h1-6H,(H2,15,17)(H2,16,18).
What are the key properties of biphenylene-1,2-dicarboxamide?
biphenylene-1,2-dicarboxamide has a molecular weight of 238.25 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for biphenylene-1,2-dicarboxamide is sourced from PubChem (CID 22057045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).