aniline;azane;1,1'-biphenyl

C18H20N2 — CID 172863138

IUPACaniline;azane;1,1'-biphenyl
SMILESN.Nc1ccccc1.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C6H7N.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;7-6-4-2-1-3-5-6;/h1-10H;1-5H,7H2;1H3
InChIKeyUUWVSGUFVFJEHC-UHFFFAOYSA-N
MW264.37 g/mol
LogP4.78
Rot. Bonds1

About aniline;azane;1,1'-biphenyl

aniline;azane;1,1'-biphenyl (PubChem CID 172863138) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is aniline;azane;1,1'-biphenyl.

Molecular Properties

Compound Nameaniline;azane;1,1'-biphenyl
PubChem CID172863138
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Nameaniline;azane;1,1'-biphenyl
SMILESN.Nc1ccccc1.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C6H7N.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;7-6-4-2-1-3-5-6;/h1-10H;1-5H,7H2;1H3
InChIKeyUUWVSGUFVFJEHC-UHFFFAOYSA-N
XLogP4.78
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of aniline;azane;1,1'-biphenyl?
The IUPAC name of aniline;azane;1,1'-biphenyl (CID 172863138) is aniline;azane;1,1'-biphenyl.
What is the SMILES notation for aniline;azane;1,1'-biphenyl?
The canonical SMILES for aniline;azane;1,1'-biphenyl is N.Nc1ccccc1.c1ccc(-c2ccccc2)cc1.
What is the InChIKey of aniline;azane;1,1'-biphenyl?
The InChIKey is UUWVSGUFVFJEHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10.C6H7N.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;7-6-4-2-1-3-5-6;/h1-10H;1-5H,7H2;1H3.
What are the key properties of aniline;azane;1,1'-biphenyl?
aniline;azane;1,1'-biphenyl has a molecular weight of 264.37 g/mol, XLogP of 4.78, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for aniline;azane;1,1'-biphenyl is sourced from PubChem (CID 172863138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).