2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol

C14H20O — CID 15438935

IUPAC2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol
SMILESCC(C)C1(O)c2ccccc2CC1(C)C
InChIInChI=1S/C14H20O/c1-10(2)14(15)12-8-6-5-7-11(12)9-13(14,3)4/h5-8,10,15H,9H2,1-4H3
InChIKeyLNOBQVJGSCXQEY-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.11
Rot. Bonds1

About 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol

2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol (PubChem CID 15438935) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol
PubChem CID15438935
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol
SMILESCC(C)C1(O)c2ccccc2CC1(C)C
InChIInChI=1S/C14H20O/c1-10(2)14(15)12-8-6-5-7-11(12)9-13(14,3)4/h5-8,10,15H,9H2,1-4H3
InChIKeyLNOBQVJGSCXQEY-UHFFFAOYSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol?
The IUPAC name of 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol (CID 15438935) is 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol.
What is the SMILES notation for 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol?
The canonical SMILES for 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol is CC(C)C1(O)c2ccccc2CC1(C)C.
What is the InChIKey of 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol?
The InChIKey is LNOBQVJGSCXQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-10(2)14(15)12-8-6-5-7-11(12)9-13(14,3)4/h5-8,10,15H,9H2,1-4H3.
What are the key properties of 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol?
2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-propan-2-yl-3H-inden-1-ol is sourced from PubChem (CID 15438935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).