1H-cyclohepta[h]quinoline

C14H11N — CID 87491065

IUPAC1H-cyclohepta[h]quinoline
SMILESC1=CC=c2ccc3c(c2C=C1)NC=CC=3
InChIInChI=1S/C14H11N/c1-2-5-11-8-9-12-6-4-10-15-14(12)13(11)7-3-1/h1-10,15H
InChIKeyHECBNWLFWSBNTE-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.77
Rot. Bonds

About 1H-cyclohepta[h]quinoline

1H-cyclohepta[h]quinoline (PubChem CID 87491065) has the molecular formula C14H11N and a molecular weight of 193.25 g/mol. Its IUPAC name is 1H-cyclohepta[h]quinoline.

Molecular Properties

Compound Name1H-cyclohepta[h]quinoline
PubChem CID87491065
Molecular FormulaC14H11N
Molecular Weight193.25 g/mol
Exact Mass193.09
IUPAC Name1H-cyclohepta[h]quinoline
SMILESC1=CC=c2ccc3c(c2C=C1)NC=CC=3
InChIInChI=1S/C14H11N/c1-2-5-11-8-9-12-6-4-10-15-14(12)13(11)7-3-1/h1-10,15H
InChIKeyHECBNWLFWSBNTE-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1H-cyclohepta[h]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1H-cyclohepta[h]quinoline?
The IUPAC name of 1H-cyclohepta[h]quinoline (CID 87491065) is 1H-cyclohepta[h]quinoline.
What is the SMILES notation for 1H-cyclohepta[h]quinoline?
The canonical SMILES for 1H-cyclohepta[h]quinoline is C1=CC=c2ccc3c(c2C=C1)NC=CC=3.
What is the InChIKey of 1H-cyclohepta[h]quinoline?
The InChIKey is HECBNWLFWSBNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N/c1-2-5-11-8-9-12-6-4-10-15-14(12)13(11)7-3-1/h1-10,15H.
What are the key properties of 1H-cyclohepta[h]quinoline?
1H-cyclohepta[h]quinoline has a molecular weight of 193.25 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-cyclohepta[h]quinoline is sourced from PubChem (CID 87491065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).