7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one

C11H7ClN2O — CID 14171570

IUPAC7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one
SMILESO=c1c2ccc(Cl)cc2[nH]n2cccc12
InChIInChI=1S/C11H7ClN2O/c12-7-3-4-8-9(6-7)13-14-5-1-2-10(14)11(8)15/h1-6,13H
InChIKeyZWFWGUSLRNIVEE-UHFFFAOYSA-N
MW218.64 g/mol
LogP2.43
Rot. Bonds

About 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one

7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one (PubChem CID 14171570) has the molecular formula C11H7ClN2O and a molecular weight of 218.64 g/mol. Its IUPAC name is 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one.

Molecular Properties

Compound Name7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one
PubChem CID14171570
Molecular FormulaC11H7ClN2O
Molecular Weight218.64 g/mol
Exact Mass218.02
IUPAC Name7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one
SMILESO=c1c2ccc(Cl)cc2[nH]n2cccc12
InChIInChI=1S/C11H7ClN2O/c12-7-3-4-8-9(6-7)13-14-5-1-2-10(14)11(8)15/h1-6,13H
InChIKeyZWFWGUSLRNIVEE-UHFFFAOYSA-N
XLogP2.43
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.64
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one?
The IUPAC name of 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one (CID 14171570) is 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one.
What is the SMILES notation for 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one?
The canonical SMILES for 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one is O=c1c2ccc(Cl)cc2[nH]n2cccc12.
What is the InChIKey of 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one?
The InChIKey is ZWFWGUSLRNIVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2O/c12-7-3-4-8-9(6-7)13-14-5-1-2-10(14)11(8)15/h1-6,13H.
What are the key properties of 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one?
7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one has a molecular weight of 218.64 g/mol, XLogP of 2.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5H-pyrrolo[1,2-b]cinnolin-10-one is sourced from PubChem (CID 14171570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).