cyclohepta[b]quinoline

C14H9N — CID 139378880

IUPACcyclohepta[b]quinoline
SMILESC1=CC=c2cc3ccccc3nc2=CC=1
InChIInChI=1S/C14H9N/c1-2-6-11-10-12-7-4-5-9-14(12)15-13(11)8-3-1/h2-10H
InChIKeyMHMRTMPPCMKHIJ-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.52
Rot. Bonds

About cyclohepta[b]quinoline

cyclohepta[b]quinoline (PubChem CID 139378880) has the molecular formula C14H9N and a molecular weight of 191.23 g/mol. Its IUPAC name is cyclohepta[b]quinoline.

Molecular Properties

Compound Namecyclohepta[b]quinoline
PubChem CID139378880
Molecular FormulaC14H9N
Molecular Weight191.23 g/mol
Exact Mass191.07
IUPAC Namecyclohepta[b]quinoline
SMILESC1=CC=c2cc3ccccc3nc2=CC=1
InChIInChI=1S/C14H9N/c1-2-6-11-10-12-7-4-5-9-14(12)15-13(11)8-3-1/h2-10H
InChIKeyMHMRTMPPCMKHIJ-UHFFFAOYSA-N
XLogP1.52
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclohepta[b]quinoline?
The IUPAC name of cyclohepta[b]quinoline (CID 139378880) is cyclohepta[b]quinoline.
What is the SMILES notation for cyclohepta[b]quinoline?
The canonical SMILES for cyclohepta[b]quinoline is C1=CC=c2cc3ccccc3nc2=CC=1.
What is the InChIKey of cyclohepta[b]quinoline?
The InChIKey is MHMRTMPPCMKHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N/c1-2-6-11-10-12-7-4-5-9-14(12)15-13(11)8-3-1/h2-10H.
What are the key properties of cyclohepta[b]quinoline?
cyclohepta[b]quinoline has a molecular weight of 191.23 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohepta[b]quinoline is sourced from PubChem (CID 139378880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).