[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol

C13H18O — CID 10535692

IUPAC[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol
SMILESC[C@@]1(CCc2ccccc2)C[C@H]1CO
InChIInChI=1S/C13H18O/c1-13(9-12(13)10-14)8-7-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3/t12-,13+/m0/s1
InChIKeyDZDIWKDXKXDZDF-QWHCGFSZSA-N
MW190.29 g/mol
LogP2.64
Rot. Bonds4

About [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol

[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol (PubChem CID 10535692) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol
PubChem CID10535692
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol
SMILESC[C@@]1(CCc2ccccc2)C[C@H]1CO
InChIInChI=1S/C13H18O/c1-13(9-12(13)10-14)8-7-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3/t12-,13+/m0/s1
InChIKeyDZDIWKDXKXDZDF-QWHCGFSZSA-N
XLogP2.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol?
The IUPAC name of [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol (CID 10535692) is [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol.
What is the SMILES notation for [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol?
The canonical SMILES for [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol is C[C@@]1(CCc2ccccc2)C[C@H]1CO.
What is the InChIKey of [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol?
The InChIKey is DZDIWKDXKXDZDF-QWHCGFSZSA-N. The full InChI is InChI=1S/C13H18O/c1-13(9-12(13)10-14)8-7-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3/t12-,13+/m0/s1.
What are the key properties of [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol?
[(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol has a molecular weight of 190.29 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-methyl-2-(2-phenylethyl)cyclopropyl]methanol is sourced from PubChem (CID 10535692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).