(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol

C16H16O — CID 14449205

IUPAC(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol
SMILESC[C@@H]1c2ccccc2C[C@]1(O)c1ccccc1
InChIInChI=1S/C16H16O/c1-12-15-10-6-5-7-13(15)11-16(12,17)14-8-3-2-4-9-14/h2-10,12,17H,11H2,1H3/t12-,16-/m1/s1
InChIKeyCJTIWPLAKOZKEO-MLGOLLRUSA-N
MW224.30 g/mol
LogP3.23
Rot. Bonds1

About (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol

(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol (PubChem CID 14449205) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol.

Molecular Properties

Compound Name(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol
PubChem CID14449205
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol
SMILESC[C@@H]1c2ccccc2C[C@]1(O)c1ccccc1
InChIInChI=1S/C16H16O/c1-12-15-10-6-5-7-13(15)11-16(12,17)14-8-3-2-4-9-14/h2-10,12,17H,11H2,1H3/t12-,16-/m1/s1
InChIKeyCJTIWPLAKOZKEO-MLGOLLRUSA-N
XLogP3.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol with MolForge

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Related Compounds

(1S,2S)-1-(methylamino)-2-phenyl-1,3-dihydroinden-2-ol
CID 138485256
(1R,2R)-1-(methylamino)-2-phenyl-1,3-dihydroinden-2-ol
CID 138485254
(1S,3S)-1,3-dimethyl-2-phenyl-1,3-dihydroinden-2-ol
CID 10537911
pentacyclo[8.7.0.02,17.03,8.011,16]heptadeca-3,5,7,11,13,15-hexaen-10-ol
CID 90482140
(1S,2R,10S,17S)-pentacyclo[8.7.0.02,17.03,8.011,16]heptadeca-3,5,7,11,13,15-hexaen-10-ol
CID 98554614
3-methyl-3-phenyl-1,4-dihydroisochromen-1-ol
CID 10728752
1-hydroxy-1-phenyl-5,9b-dihydro-2H-pyrrolo[2,1-a]isoindol-3-one
CID 576510
1-bromo-2-methyl-1,3-dihydroinden-2-ol
CID 174888924
cis-(1R,2R)-2-methyl-1-phenylcyclopentan-1-ol
CID 12611391
trans-(1S,2R)-2,4,4-trimethyl-1-phenylcyclopentan-1-ol
CID 124681224
(1S,8R,9S)-9-phenyltricyclo[6.2.1.02,7]undeca-2,4,6-trien-9-ol
CID 98477563
(1R,2S,5R)-2,5-dimethyl-1-phenylcyclohexan-1-ol
CID 124672757

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol?
The IUPAC name of (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol (CID 14449205) is (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol.
What is the SMILES notation for (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol?
The canonical SMILES for (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol is C[C@@H]1c2ccccc2C[C@]1(O)c1ccccc1.
What is the InChIKey of (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol?
The InChIKey is CJTIWPLAKOZKEO-MLGOLLRUSA-N. The full InChI is InChI=1S/C16H16O/c1-12-15-10-6-5-7-13(15)11-16(12,17)14-8-3-2-4-9-14/h2-10,12,17H,11H2,1H3/t12-,16-/m1/s1.
What are the key properties of (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol?
(1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol has a molecular weight of 224.30 g/mol, XLogP of 3.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-1-methyl-2-phenyl-1,3-dihydroinden-2-ol is sourced from PubChem (CID 14449205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).