6H-cyclopropa[g]isoquinoline

C10H7N — CID 142805400

IUPAC6H-cyclopropa[g]isoquinoline
SMILESc1cc2cc3c(cc2cn1)C3
InChIInChI=1S/C10H7N/c1-2-11-6-10-5-9-4-8(9)3-7(1)10/h1-3,5-6H,4H2
InChIKeyWTMQPCPHDWLBJP-UHFFFAOYSA-N
MW141.17 g/mol
LogP2.14
Rot. Bonds

About 6H-cyclopropa[g]isoquinoline

6H-cyclopropa[g]isoquinoline (PubChem CID 142805400) has the molecular formula C10H7N and a molecular weight of 141.17 g/mol. Its IUPAC name is 6H-cyclopropa[g]isoquinoline.

Molecular Properties

Compound Name6H-cyclopropa[g]isoquinoline
PubChem CID142805400
Molecular FormulaC10H7N
Molecular Weight141.17 g/mol
Exact Mass141.06
IUPAC Name6H-cyclopropa[g]isoquinoline
SMILESc1cc2cc3c(cc2cn1)C3
InChIInChI=1S/C10H7N/c1-2-11-6-10-5-9-4-8(9)3-7(1)10/h1-3,5-6H,4H2
InChIKeyWTMQPCPHDWLBJP-UHFFFAOYSA-N
XLogP2.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6H-cyclopropa[g]isoquinoline?
The IUPAC name of 6H-cyclopropa[g]isoquinoline (CID 142805400) is 6H-cyclopropa[g]isoquinoline.
What is the SMILES notation for 6H-cyclopropa[g]isoquinoline?
The canonical SMILES for 6H-cyclopropa[g]isoquinoline is c1cc2cc3c(cc2cn1)C3.
What is the InChIKey of 6H-cyclopropa[g]isoquinoline?
The InChIKey is WTMQPCPHDWLBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N/c1-2-11-6-10-5-9-4-8(9)3-7(1)10/h1-3,5-6H,4H2.
What are the key properties of 6H-cyclopropa[g]isoquinoline?
6H-cyclopropa[g]isoquinoline has a molecular weight of 141.17 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-cyclopropa[g]isoquinoline is sourced from PubChem (CID 142805400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).