cyclopropyl-(4-methoxyphenyl)-phenylmethanol

C17H18O2 — CID 614704

IUPACcyclopropyl-(4-methoxyphenyl)-phenylmethanol
SMILESCOc1ccc(C(O)(c2ccccc2)C2CC2)cc1
InChIInChI=1S/C17H18O2/c1-19-16-11-9-15(10-12-16)17(18,14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,18H,7-8H2,1H3
InChIKeySIRULVGQLZGELT-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.34
Rot. Bonds4

About cyclopropyl-(4-methoxyphenyl)-phenylmethanol

cyclopropyl-(4-methoxyphenyl)-phenylmethanol (PubChem CID 614704) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is cyclopropyl-(4-methoxyphenyl)-phenylmethanol.

Molecular Properties

Compound Namecyclopropyl-(4-methoxyphenyl)-phenylmethanol
PubChem CID614704
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Namecyclopropyl-(4-methoxyphenyl)-phenylmethanol
SMILESCOc1ccc(C(O)(c2ccccc2)C2CC2)cc1
InChIInChI=1S/C17H18O2/c1-19-16-11-9-15(10-12-16)17(18,14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,18H,7-8H2,1H3
InChIKeySIRULVGQLZGELT-UHFFFAOYSA-N
XLogP3.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(4-methoxyphenyl)-phenylmethanol?
The IUPAC name of cyclopropyl-(4-methoxyphenyl)-phenylmethanol (CID 614704) is cyclopropyl-(4-methoxyphenyl)-phenylmethanol.
What is the SMILES notation for cyclopropyl-(4-methoxyphenyl)-phenylmethanol?
The canonical SMILES for cyclopropyl-(4-methoxyphenyl)-phenylmethanol is COc1ccc(C(O)(c2ccccc2)C2CC2)cc1.
What is the InChIKey of cyclopropyl-(4-methoxyphenyl)-phenylmethanol?
The InChIKey is SIRULVGQLZGELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-19-16-11-9-15(10-12-16)17(18,14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,18H,7-8H2,1H3.
What are the key properties of cyclopropyl-(4-methoxyphenyl)-phenylmethanol?
cyclopropyl-(4-methoxyphenyl)-phenylmethanol has a molecular weight of 254.33 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-methoxyphenyl)-phenylmethanol is sourced from PubChem (CID 614704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).