5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol

C13H18ClNO — CID 68883162

IUPAC5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol
SMILESCc1ccc(Cl)c2c1NC(C)(C)C(O)C2C
InChIInChI=1S/C13H18ClNO/c1-7-5-6-9(14)10-8(2)12(16)13(3,4)15-11(7)10/h5-6,8,12,15-16H,1-4H3
InChIKeyJINQFCDGPKEVBN-UHFFFAOYSA-N
MW239.75 g/mol
LogP3.32
Rot. Bonds

About 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol

5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol (PubChem CID 68883162) has the molecular formula C13H18ClNO and a molecular weight of 239.75 g/mol. Its IUPAC name is 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol.

Molecular Properties

Compound Name5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol
PubChem CID68883162
Molecular FormulaC13H18ClNO
Molecular Weight239.75 g/mol
Exact Mass239.11
IUPAC Name5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol
SMILESCc1ccc(Cl)c2c1NC(C)(C)C(O)C2C
InChIInChI=1S/C13H18ClNO/c1-7-5-6-9(14)10-8(2)12(16)13(3,4)15-11(7)10/h5-6,8,12,15-16H,1-4H3
InChIKeyJINQFCDGPKEVBN-UHFFFAOYSA-N
XLogP3.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol?
The IUPAC name of 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol (CID 68883162) is 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol.
What is the SMILES notation for 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol?
The canonical SMILES for 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol is Cc1ccc(Cl)c2c1NC(C)(C)C(O)C2C.
What is the InChIKey of 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol?
The InChIKey is JINQFCDGPKEVBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO/c1-7-5-6-9(14)10-8(2)12(16)13(3,4)15-11(7)10/h5-6,8,12,15-16H,1-4H3.
What are the key properties of 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol?
5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol has a molecular weight of 239.75 g/mol, XLogP of 3.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2,2,4,8-tetramethyl-3,4-dihydro-1H-quinolin-3-ol is sourced from PubChem (CID 68883162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).