4-chloro-5,6,7,8-tetrahydroquinolin-8-ol

C9H10ClNO — CID 74892841

IUPAC4-chloro-5,6,7,8-tetrahydroquinolin-8-ol
SMILESOC1CCCc2c(Cl)ccnc21
InChIInChI=1S/C9H10ClNO/c10-7-4-5-11-9-6(7)2-1-3-8(9)12/h4-5,8,12H,1-3H2
InChIKeyOYDHRDQQGNQCPY-UHFFFAOYSA-N
MW183.64 g/mol
LogP2.10
Rot. Bonds

About 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol

4-chloro-5,6,7,8-tetrahydroquinolin-8-ol (PubChem CID 74892841) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol.

Molecular Properties

Compound Name4-chloro-5,6,7,8-tetrahydroquinolin-8-ol
PubChem CID74892841
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC Name4-chloro-5,6,7,8-tetrahydroquinolin-8-ol
SMILESOC1CCCc2c(Cl)ccnc21
InChIInChI=1S/C9H10ClNO/c10-7-4-5-11-9-6(7)2-1-3-8(9)12/h4-5,8,12H,1-3H2
InChIKeyOYDHRDQQGNQCPY-UHFFFAOYSA-N
XLogP2.10
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol?
The IUPAC name of 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol (CID 74892841) is 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol.
What is the SMILES notation for 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol?
The canonical SMILES for 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol is OC1CCCc2c(Cl)ccnc21.
What is the InChIKey of 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol?
The InChIKey is OYDHRDQQGNQCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO/c10-7-4-5-11-9-6(7)2-1-3-8(9)12/h4-5,8,12H,1-3H2.
What are the key properties of 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol?
4-chloro-5,6,7,8-tetrahydroquinolin-8-ol has a molecular weight of 183.64 g/mol, XLogP of 2.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5,6,7,8-tetrahydroquinolin-8-ol is sourced from PubChem (CID 74892841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).