2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol

C13H19NO — CID 59639100

IUPAC2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol
SMILESCc1cc2c(cc1O)C(C)CC(C)(C)N2
InChIInChI=1S/C13H19NO/c1-8-5-11-10(6-12(8)15)9(2)7-13(3,4)14-11/h5-6,9,14-15H,7H2,1-4H3
InChIKeyIPWDKPQDCXVYTJ-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.40
Rot. Bonds

About 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol

2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol (PubChem CID 59639100) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol.

Molecular Properties

Compound Name2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol
PubChem CID59639100
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol
SMILESCc1cc2c(cc1O)C(C)CC(C)(C)N2
InChIInChI=1S/C13H19NO/c1-8-5-11-10(6-12(8)15)9(2)7-13(3,4)14-11/h5-6,9,14-15H,7H2,1-4H3
InChIKeyIPWDKPQDCXVYTJ-UHFFFAOYSA-N
XLogP3.40
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol?
The IUPAC name of 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol (CID 59639100) is 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol.
What is the SMILES notation for 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol?
The canonical SMILES for 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol is Cc1cc2c(cc1O)C(C)CC(C)(C)N2.
What is the InChIKey of 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol?
The InChIKey is IPWDKPQDCXVYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-8-5-11-10(6-12(8)15)9(2)7-13(3,4)14-11/h5-6,9,14-15H,7H2,1-4H3.
What are the key properties of 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol?
2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol has a molecular weight of 205.30 g/mol, XLogP of 3.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-ol is sourced from PubChem (CID 59639100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).