8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline

C12H9BrClNO — CID 106471013

IUPAC8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
SMILESClc1c2c(nc3ccc(Br)cc13)CCOC2
InChIInChI=1S/C12H9BrClNO/c13-7-1-2-10-8(5-7)12(14)9-6-16-4-3-11(9)15-10/h1-2,5H,3-4,6H2
InChIKeyTYTDEIOLMJAEDN-UHFFFAOYSA-N
MW298.57 g/mol
LogP3.72
Rot. Bonds

About 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline

8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline (PubChem CID 106471013) has the molecular formula C12H9BrClNO and a molecular weight of 298.57 g/mol. Its IUPAC name is 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline.

Molecular Properties

Compound Name8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
PubChem CID106471013
Molecular FormulaC12H9BrClNO
Molecular Weight298.57 g/mol
Exact Mass296.96
IUPAC Name8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
SMILESClc1c2c(nc3ccc(Br)cc13)CCOC2
InChIInChI=1S/C12H9BrClNO/c13-7-1-2-10-8(5-7)12(14)9-6-16-4-3-11(9)15-10/h1-2,5H,3-4,6H2
InChIKeyTYTDEIOLMJAEDN-UHFFFAOYSA-N
XLogP3.72
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.57
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline with MolForge

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Launch Full Analysis

Related Compounds

10-chloro-8-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471001
8,10-dichloro-7-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471040
8-bromo-6,7,10-trichloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 114002088
8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 107622850
10-chloro-6,7,8-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471008
8-bromo-6-chloro-N-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473049
11-chloro-14-oxa-18-azatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),8,11,17-pentaene
CID 106470978
10-chloro-7-fluoro-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471021
(7-bromo-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 62251532
2-[(3-bromophenyl)methyl]-4-chloro-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
CID 106470645
(8-tert-butyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)hydrazine
CID 106473750
N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473014

Frequently Asked Questions

What is the IUPAC name of 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The IUPAC name of 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline (CID 106471013) is 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline.
What is the SMILES notation for 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The canonical SMILES for 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline is Clc1c2c(nc3ccc(Br)cc13)CCOC2.
What is the InChIKey of 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The InChIKey is TYTDEIOLMJAEDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNO/c13-7-1-2-10-8(5-7)12(14)9-6-16-4-3-11(9)15-10/h1-2,5H,3-4,6H2.
What are the key properties of 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline has a molecular weight of 298.57 g/mol, XLogP of 3.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline is sourced from PubChem (CID 106471013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).