1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol

C19H22O2 — CID 116516743

IUPAC1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol
SMILESCOc1ccc(CC(C)(O)C2CC2c2ccccc2)cc1
InChIInChI=1S/C19H22O2/c1-19(20,13-14-8-10-16(21-2)11-9-14)18-12-17(18)15-6-4-3-5-7-15/h3-11,17-18,20H,12-13H2,1-2H3
InChIKeyBNLWHUQXQAZGRP-UHFFFAOYSA-N
MW282.38 g/mol
LogP3.79
Rot. Bonds5

About 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol

1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol (PubChem CID 116516743) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol
PubChem CID116516743
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol
SMILESCOc1ccc(CC(C)(O)C2CC2c2ccccc2)cc1
InChIInChI=1S/C19H22O2/c1-19(20,13-14-8-10-16(21-2)11-9-14)18-12-17(18)15-6-4-3-5-7-15/h3-11,17-18,20H,12-13H2,1-2H3
InChIKeyBNLWHUQXQAZGRP-UHFFFAOYSA-N
XLogP3.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1S,2S)-2-phenylcyclopropyl]propan-2-ol
CID 102315759
trans-(1R,2R)-N-[2-(4-methoxyphenyl)ethyl]-2-phenylcyclopropane-1-carboxamide
CID 896868
[2-(4-methoxyphenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105205565
1-(4-methoxyphenyl)-2-(2-methylphenyl)propan-2-ol
CID 55169667
[(1S)-2-tert-butylcyclopropyl]benzene
CID 59541250
(4-methoxyphenyl)methyl-phenyliodanium
CID 22385450
3-benzyl-4-(4-methoxyphenyl)-3-methylbutanoic acid
CID 18624156
1-(2,2-dimethylpropyl)-4-[1-(4-methoxyphenyl)-2,2-dimethyl-1-phenylpropyl]benzene
CID 135291592
1-methoxy-4-(3-phenylcyclobutyl)benzene
CID 125465439
3-hydroxy-4-(4-methoxyphenyl)-2,2,3-trimethylbutanenitrile
CID 79129241
1-ethyl-2-[(4-methoxyphenyl)methyl]-3-[(2-phenylcyclopropyl)methyl]guanidine
CID 111558479
1-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-[(2-phenylcyclopropyl)methyl]guanidine;hydroiodide
CID 111558512

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol?
The IUPAC name of 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol (CID 116516743) is 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol is COc1ccc(CC(C)(O)C2CC2c2ccccc2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol?
The InChIKey is BNLWHUQXQAZGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-19(20,13-14-8-10-16(21-2)11-9-14)18-12-17(18)15-6-4-3-5-7-15/h3-11,17-18,20H,12-13H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol?
1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol has a molecular weight of 282.38 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol is sourced from PubChem (CID 116516743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).