2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol

C15H24O — CID 583110

IUPAC2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol
SMILESCC1=CC=CC2(C)CCC(C(C)(C)O)CC12
InChIInChI=1S/C15H24O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h5-6,8,12-13,16H,7,9-10H2,1-4H3
InChIKeyAMZWKSYAMHGGSR-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds1

About 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol

2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol (PubChem CID 583110) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol
PubChem CID583110
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol
SMILESCC1=CC=CC2(C)CCC(C(C)(C)O)CC12
InChIInChI=1S/C15H24O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h5-6,8,12-13,16H,7,9-10H2,1-4H3
InChIKeyAMZWKSYAMHGGSR-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 91457
Elemol
CID 92138
Alpha-eudesmol
CID 92762
(+)-gamma-Eudesmol
CID 6432005
epi-alpha-Cadinol
CID 160799
Alpha-Cadinol
CID 10398656
1,2,3,4,4a,5,6,7-Octahydro-2,5,5-trimethyl-2-naphthalenol
CID 162452
10-epi-gamma-Eudesmol
CID 6430754
(1R,2R,4aS,8aS)-Decahydro-2,5,5,8a-tetramethyl-1-((2Z)-3-methyl-2,4-pentadien-1-yl)-2-naphthalenol
CID 643723
2-(4-Ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl)propan-2-ol
CID 547972
Valerianol
CID 9859337
Chamomillol
CID 102095305

Frequently Asked Questions

What is the IUPAC name of 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol?
The IUPAC name of 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol (CID 583110) is 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol.
What is the SMILES notation for 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol?
The canonical SMILES for 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol is CC1=CC=CC2(C)CCC(C(C)(C)O)CC12.
What is the InChIKey of 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol?
The InChIKey is AMZWKSYAMHGGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h5-6,8,12-13,16H,7,9-10H2,1-4H3.
What are the key properties of 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol?
2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4a,8-dimethyl-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propan-2-ol is sourced from PubChem (CID 583110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).