6-chloro-11aH-indeno[1,2-b]quinoline

C16H10ClN — CID 141243401

IUPAC6-chloro-11aH-indeno[1,2-b]quinoline
SMILESClc1cccc2cc3c(nc12)=C1C=CC=CC1C=3
InChIInChI=1S/C16H10ClN/c17-14-7-3-5-11-9-12-8-10-4-1-2-6-13(10)15(12)18-16(11)14/h1-10H
InChIKeyOEWSQMWZQSIEQQ-UHFFFAOYSA-N
MW251.72 g/mol
LogP2.58
Rot. Bonds

About 6-chloro-11aH-indeno[1,2-b]quinoline

6-chloro-11aH-indeno[1,2-b]quinoline (PubChem CID 141243401) has the molecular formula C16H10ClN and a molecular weight of 251.72 g/mol. Its IUPAC name is 6-chloro-11aH-indeno[1,2-b]quinoline.

Molecular Properties

Compound Name6-chloro-11aH-indeno[1,2-b]quinoline
PubChem CID141243401
Molecular FormulaC16H10ClN
Molecular Weight251.72 g/mol
Exact Mass251.05
IUPAC Name6-chloro-11aH-indeno[1,2-b]quinoline
SMILESClc1cccc2cc3c(nc12)=C1C=CC=CC1C=3
InChIInChI=1S/C16H10ClN/c17-14-7-3-5-11-9-12-8-10-4-1-2-6-13(10)15(12)18-16(11)14/h1-10H
InChIKeyOEWSQMWZQSIEQQ-UHFFFAOYSA-N
XLogP2.58
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.72
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-11aH-indeno[1,2-b]quinoline?
The IUPAC name of 6-chloro-11aH-indeno[1,2-b]quinoline (CID 141243401) is 6-chloro-11aH-indeno[1,2-b]quinoline.
What is the SMILES notation for 6-chloro-11aH-indeno[1,2-b]quinoline?
The canonical SMILES for 6-chloro-11aH-indeno[1,2-b]quinoline is Clc1cccc2cc3c(nc12)=C1C=CC=CC1C=3.
What is the InChIKey of 6-chloro-11aH-indeno[1,2-b]quinoline?
The InChIKey is OEWSQMWZQSIEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN/c17-14-7-3-5-11-9-12-8-10-4-1-2-6-13(10)15(12)18-16(11)14/h1-10H.
What are the key properties of 6-chloro-11aH-indeno[1,2-b]quinoline?
6-chloro-11aH-indeno[1,2-b]quinoline has a molecular weight of 251.72 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-11aH-indeno[1,2-b]quinoline is sourced from PubChem (CID 141243401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).