5,6-dihydrobenzo[h]cinnolin-3-amine

C12H11N3 — CID 5288116

IUPAC5,6-dihydrobenzo[h]cinnolin-3-amine
SMILESNc1cc2c(nn1)-c1ccccc1CC2
InChIInChI=1S/C12H11N3/c13-11-7-9-6-5-8-3-1-2-4-10(8)12(9)15-14-11/h1-4,7H,5-6H2,(H2,13,14)
InChIKeyQKVREUJWFZJEJK-UHFFFAOYSA-N
MW197.24 g/mol
LogP1.82
Rot. Bonds

About 5,6-dihydrobenzo[h]cinnolin-3-amine

5,6-dihydrobenzo[h]cinnolin-3-amine (PubChem CID 5288116) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 5,6-dihydrobenzo[h]cinnolin-3-amine.

Molecular Properties

Compound Name5,6-dihydrobenzo[h]cinnolin-3-amine
PubChem CID5288116
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name5,6-dihydrobenzo[h]cinnolin-3-amine
SMILESNc1cc2c(nn1)-c1ccccc1CC2
InChIInChI=1S/C12H11N3/c13-11-7-9-6-5-8-3-1-2-4-10(8)12(9)15-14-11/h1-4,7H,5-6H2,(H2,13,14)
InChIKeyQKVREUJWFZJEJK-UHFFFAOYSA-N
XLogP1.82
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydrobenzo[h]cinnolin-3-amine?
The IUPAC name of 5,6-dihydrobenzo[h]cinnolin-3-amine (CID 5288116) is 5,6-dihydrobenzo[h]cinnolin-3-amine.
What is the SMILES notation for 5,6-dihydrobenzo[h]cinnolin-3-amine?
The canonical SMILES for 5,6-dihydrobenzo[h]cinnolin-3-amine is Nc1cc2c(nn1)-c1ccccc1CC2.
What is the InChIKey of 5,6-dihydrobenzo[h]cinnolin-3-amine?
The InChIKey is QKVREUJWFZJEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c13-11-7-9-6-5-8-3-1-2-4-10(8)12(9)15-14-11/h1-4,7H,5-6H2,(H2,13,14).
What are the key properties of 5,6-dihydrobenzo[h]cinnolin-3-amine?
5,6-dihydrobenzo[h]cinnolin-3-amine has a molecular weight of 197.24 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydrobenzo[h]cinnolin-3-amine is sourced from PubChem (CID 5288116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).