(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol

C11H15NO — CID 89041551

IUPAC(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol
SMILESCc1cnc2c(c1)CC(O)[C@H](C)C2
InChIInChI=1S/C11H15NO/c1-7-3-9-5-11(13)8(2)4-10(9)12-6-7/h3,6,8,11,13H,4-5H2,1-2H3/t8-,11?/m1/s1
InChIKeyNERRKUDELDBPIP-RZZZFEHKSA-N
MW177.25 g/mol
LogP1.49
Rot. Bonds

About (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol

(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol (PubChem CID 89041551) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol.

Molecular Properties

Compound Name(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol
PubChem CID89041551
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol
SMILESCc1cnc2c(c1)CC(O)[C@H](C)C2
InChIInChI=1S/C11H15NO/c1-7-3-9-5-11(13)8(2)4-10(9)12-6-7/h3,6,8,11,13H,4-5H2,1-2H3/t8-,11?/m1/s1
InChIKeyNERRKUDELDBPIP-RZZZFEHKSA-N
XLogP1.49
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol?
The IUPAC name of (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol (CID 89041551) is (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol.
What is the SMILES notation for (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol?
The canonical SMILES for (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol is Cc1cnc2c(c1)CC(O)[C@H](C)C2.
What is the InChIKey of (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol?
The InChIKey is NERRKUDELDBPIP-RZZZFEHKSA-N. The full InChI is InChI=1S/C11H15NO/c1-7-3-9-5-11(13)8(2)4-10(9)12-6-7/h3,6,8,11,13H,4-5H2,1-2H3/t8-,11?/m1/s1.
What are the key properties of (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol?
(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol has a molecular weight of 177.25 g/mol, XLogP of 1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol is sourced from PubChem (CID 89041551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).