2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol

C20H32O — CID 116525912

IUPAC2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol
SMILESCC(C)C(C)C(O)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIInChI=1S/C20H32O/c1-13(2)14(3)18(21)15-8-9-16-17(12-15)20(6,7)11-10-19(16,4)5/h8-9,12-14,18,21H,10-11H2,1-7H3
InChIKeyLATBTAVKCYQPAC-UHFFFAOYSA-N
MW288.48 g/mol
LogP5.36
Rot. Bonds3

About 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol

2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol (PubChem CID 116525912) has the molecular formula C20H32O and a molecular weight of 288.48 g/mol. Its IUPAC name is 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol.

Molecular Properties

Compound Name2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol
PubChem CID116525912
Molecular FormulaC20H32O
Molecular Weight288.48 g/mol
Exact Mass288.25
IUPAC Name2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol
SMILESCC(C)C(C)C(O)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIInChI=1S/C20H32O/c1-13(2)14(3)18(21)15-8-9-16-17(12-15)20(6,7)11-10-19(16,4)5/h8-9,12-14,18,21H,10-11H2,1-7H3
InChIKeyLATBTAVKCYQPAC-UHFFFAOYSA-N
XLogP5.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.48
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol with MolForge

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Related Compounds

6-(1-chloroethyl)-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 71633194
6-[(1R)-1-chloroethyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 97175249
(2R)-2-hydroxy-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)acetic acid
CID 11184593
1-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethanol
CID 20543027
(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-thiophen-2-ylmethanol
CID 116525903
2-methylsulfonyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanol
CID 116525905
4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pentanoic acid
CID 116525810
1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pentan-1-amine
CID 116525818
4-amino-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butanoic acid
CID 116525863
(2,2-dimethylcyclopropyl)-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methanamine
CID 107001422
4-[2-hydroxy-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanethioyl]benzoic acid
CID 57073423
3,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-amine
CID 116525828

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol?
The IUPAC name of 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol (CID 116525912) is 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol.
What is the SMILES notation for 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol?
The canonical SMILES for 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol is CC(C)C(C)C(O)c1ccc2c(c1)C(C)(C)CCC2(C)C.
What is the InChIKey of 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol?
The InChIKey is LATBTAVKCYQPAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32O/c1-13(2)14(3)18(21)15-8-9-16-17(12-15)20(6,7)11-10-19(16,4)5/h8-9,12-14,18,21H,10-11H2,1-7H3.
What are the key properties of 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol?
2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol has a molecular weight of 288.48 g/mol, XLogP of 5.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butan-1-ol is sourced from PubChem (CID 116525912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).