(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol

C17H17FO — CID 55179614

IUPAC(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
SMILESCc1ccc(F)c(C(O)C2(c3ccccc3)CC2)c1
InChIInChI=1S/C17H17FO/c1-12-7-8-15(18)14(11-12)16(19)17(9-10-17)13-5-3-2-4-6-13/h2-8,11,16,19H,9-10H2,1H3
InChIKeyYDKLFSHAMMBHCI-UHFFFAOYSA-N
MW256.32 g/mol
LogP3.90
Rot. Bonds3

About (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol

(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol (PubChem CID 55179614) has the molecular formula C17H17FO and a molecular weight of 256.32 g/mol. Its IUPAC name is (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol.

Molecular Properties

Compound Name(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
PubChem CID55179614
Molecular FormulaC17H17FO
Molecular Weight256.32 g/mol
Exact Mass256.13
IUPAC Name(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
SMILESCc1ccc(F)c(C(O)C2(c3ccccc3)CC2)c1
InChIInChI=1S/C17H17FO/c1-12-7-8-15(18)14(11-12)16(19)17(9-10-17)13-5-3-2-4-6-13/h2-8,11,16,19H,9-10H2,1H3
InChIKeyYDKLFSHAMMBHCI-UHFFFAOYSA-N
XLogP3.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-4-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
CID 81044939
1-[(2-fluoro-5-methylphenyl)-hydroxymethyl]-4-methylcyclohexan-1-ol
CID 103452318
(2-chloro-5-fluorophenyl)-(1-phenylcyclopropyl)methanol
CID 105394462
(5-fluoro-2-methoxyphenyl)-(1-phenylcyclopropyl)methanol
CID 62881250
(3-methylphenyl)-(1-phenylcyclopentyl)methanol
CID 63414399
(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol
CID 103395378
(4-methyl-3-pyridinyl)-(1-phenylcyclopropyl)methanol
CID 66271184
1-[chloro-(1-phenylcyclopropyl)methyl]-2,4-difluoro-5-methylbenzene
CID 79730806
2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol
CID 63017736
2-(4-chloro-2-fluorophenyl)-1-(1-phenylcyclopropyl)ethanol
CID 114854613
(2-ethoxyphenyl)-(1-phenylcyclopropyl)methanol
CID 63079301
4-[bromo-(1-phenylcyclopropyl)methyl]-1-fluoro-2-methylbenzene
CID 79746419

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol?
The IUPAC name of (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol (CID 55179614) is (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol.
What is the SMILES notation for (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol?
The canonical SMILES for (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol is Cc1ccc(F)c(C(O)C2(c3ccccc3)CC2)c1.
What is the InChIKey of (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol?
The InChIKey is YDKLFSHAMMBHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO/c1-12-7-8-15(18)14(11-12)16(19)17(9-10-17)13-5-3-2-4-6-13/h2-8,11,16,19H,9-10H2,1H3.
What are the key properties of (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol?
(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol has a molecular weight of 256.32 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol is sourced from PubChem (CID 55179614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).