3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol

C12H16O — CID 163891740

IUPAC3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESCc1ccc2c(c1)CC(O)C(C)C2
InChIInChI=1S/C12H16O/c1-8-3-4-10-6-9(2)12(13)7-11(10)5-8/h3-5,9,12-13H,6-7H2,1-2H3
InChIKeyQCCRLNLXTQRGLI-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.09
Rot. Bonds

About 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol

3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol (PubChem CID 163891740) has the molecular formula C12H16O and a molecular weight of 176.26 g/mol. Its IUPAC name is 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol
PubChem CID163891740
Molecular FormulaC12H16O
Molecular Weight176.26 g/mol
Exact Mass176.12
IUPAC Name3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESCc1ccc2c(c1)CC(O)C(C)C2
InChIInChI=1S/C12H16O/c1-8-3-4-10-6-9(2)12(13)7-11(10)5-8/h3-5,9,12-13H,6-7H2,1-2H3
InChIKeyQCCRLNLXTQRGLI-UHFFFAOYSA-N
XLogP2.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S,3S)-6-bromo-3-methyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 147048026
N,5-dimethyl-2,3-dihydro-1H-inden-2-amine
CID 23397060
(7R)-3,7-dimethyl-5,6,7,8-tetrahydroquinolin-6-ol
CID 89041551
(1R)-2,6-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 130738908
2,7-dimethyl-1,2,3,4-tetrahydronaphthalene;ethane
CID 145046662
2-(5-methyl-2,3-dihydro-1H-inden-2-yl)propan-2-amine
CID 105443946
N-cyclopropyl-5-methyl-2,3-dihydro-1H-inden-2-amine
CID 83829022
(2R)-1-[(2,6-dimethyl-2,3-dihydro-1H-inden-1-yl)amino]propan-2-ol
CID 103949520
(2S,3R)-1,2,3,6-tetramethyl-3,4-dihydro-2H-quinoline
CID 139325985
6-bromo-2,3-dimethyl-1,2,3,4-tetrahydronaphthalene
CID 162045632
methyl 2-(5-methyl-2,3-dihydro-1H-inden-2-yl)acetate
CID 20765973
(1R,2S)-N-(1-fluoroethyl)-2,6-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 173049230

Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol?
The IUPAC name of 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol (CID 163891740) is 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol?
The canonical SMILES for 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol is Cc1ccc2c(c1)CC(O)C(C)C2.
What is the InChIKey of 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol?
The InChIKey is QCCRLNLXTQRGLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O/c1-8-3-4-10-6-9(2)12(13)7-11(10)5-8/h3-5,9,12-13H,6-7H2,1-2H3.
What are the key properties of 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol?
3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol has a molecular weight of 176.26 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 163891740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).