1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol

C17H18O — CID 117349615

IUPAC1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol
SMILESCc1ccc(CC2(O)CC2)cc1-c1ccccc1
InChIInChI=1S/C17H18O/c1-13-7-8-14(12-17(18)9-10-17)11-16(13)15-5-3-2-4-6-15/h2-8,11,18H,9-10,12H2,1H3
InChIKeyNQWGWPWSSMSHOK-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.73
Rot. Bonds3

About 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol

1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol (PubChem CID 117349615) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol
PubChem CID117349615
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol
SMILESCc1ccc(CC2(O)CC2)cc1-c1ccccc1
InChIInChI=1S/C17H18O/c1-13-7-8-14(12-17(18)9-10-17)11-16(13)15-5-3-2-4-6-15/h2-8,11,18H,9-10,12H2,1H3
InChIKeyNQWGWPWSSMSHOK-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol?
The IUPAC name of 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol (CID 117349615) is 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol is Cc1ccc(CC2(O)CC2)cc1-c1ccccc1.
What is the InChIKey of 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol?
The InChIKey is NQWGWPWSSMSHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-13-7-8-14(12-17(18)9-10-17)11-16(13)15-5-3-2-4-6-15/h2-8,11,18H,9-10,12H2,1H3.
What are the key properties of 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol?
1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol has a molecular weight of 238.33 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol is sourced from PubChem (CID 117349615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).