1H-cyclopenta[h]quinoline

C12H9N — CID 87329973

IUPAC1H-cyclopenta[h]quinoline
SMILESc1c[nH]c2c(c1)ccc1cccc12
InChIInChI=1S/C12H9N/c1-3-9-6-7-10-4-2-8-13-12(10)11(9)5-1/h1-8,13H
InChIKeyNKHZINRPHKMTLU-UHFFFAOYSA-N
MW167.21 g/mol
LogP3.32
Rot. Bonds

About 1H-cyclopenta[h]quinoline

1H-cyclopenta[h]quinoline (PubChem CID 87329973) has the molecular formula C12H9N and a molecular weight of 167.21 g/mol. Its IUPAC name is 1H-cyclopenta[h]quinoline.

Molecular Properties

Compound Name1H-cyclopenta[h]quinoline
PubChem CID87329973
Molecular FormulaC12H9N
Molecular Weight167.21 g/mol
Exact Mass167.07
IUPAC Name1H-cyclopenta[h]quinoline
SMILESc1c[nH]c2c(c1)ccc1cccc12
InChIInChI=1S/C12H9N/c1-3-9-6-7-10-4-2-8-13-12(10)11(9)5-1/h1-8,13H
InChIKeyNKHZINRPHKMTLU-UHFFFAOYSA-N
XLogP3.32
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1H-cyclopenta[h]quinoline?
The IUPAC name of 1H-cyclopenta[h]quinoline (CID 87329973) is 1H-cyclopenta[h]quinoline.
What is the SMILES notation for 1H-cyclopenta[h]quinoline?
The canonical SMILES for 1H-cyclopenta[h]quinoline is c1c[nH]c2c(c1)ccc1cccc12.
What is the InChIKey of 1H-cyclopenta[h]quinoline?
The InChIKey is NKHZINRPHKMTLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N/c1-3-9-6-7-10-4-2-8-13-12(10)11(9)5-1/h1-8,13H.
What are the key properties of 1H-cyclopenta[h]quinoline?
1H-cyclopenta[h]quinoline has a molecular weight of 167.21 g/mol, XLogP of 3.32, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-cyclopenta[h]quinoline is sourced from PubChem (CID 87329973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).