8,9-dihydro-6H-pyrido[1,2-a]indol-7-one

C12H11NO — CID 15063399

IUPAC8,9-dihydro-6H-pyrido[1,2-a]indol-7-one
SMILESO=C1CCc2cc3ccccc3n2C1
InChIInChI=1S/C12H11NO/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-4,7H,5-6,8H2
InChIKeyPQHGPIHLRAAIDG-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.16
Rot. Bonds

About 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one

8,9-dihydro-6H-pyrido[1,2-a]indol-7-one (PubChem CID 15063399) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one.

Molecular Properties

Compound Name8,9-dihydro-6H-pyrido[1,2-a]indol-7-one
PubChem CID15063399
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name8,9-dihydro-6H-pyrido[1,2-a]indol-7-one
SMILESO=C1CCc2cc3ccccc3n2C1
InChIInChI=1S/C12H11NO/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-4,7H,5-6,8H2
InChIKeyPQHGPIHLRAAIDG-UHFFFAOYSA-N
XLogP2.16
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one?
The IUPAC name of 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one (CID 15063399) is 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one.
What is the SMILES notation for 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one?
The canonical SMILES for 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one is O=C1CCc2cc3ccccc3n2C1.
What is the InChIKey of 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one?
The InChIKey is PQHGPIHLRAAIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-4,7H,5-6,8H2.
What are the key properties of 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one?
8,9-dihydro-6H-pyrido[1,2-a]indol-7-one has a molecular weight of 185.23 g/mol, XLogP of 2.16, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dihydro-6H-pyrido[1,2-a]indol-7-one is sourced from PubChem (CID 15063399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).