cycloheptyl-(3-fluoro-5-methylphenyl)methanol

C15H21FO — CID 79703242

IUPACcycloheptyl-(3-fluoro-5-methylphenyl)methanol
SMILESCc1cc(F)cc(C(O)C2CCCCCC2)c1
InChIInChI=1S/C15H21FO/c1-11-8-13(10-14(16)9-11)15(17)12-6-4-2-3-5-7-12/h8-10,12,15,17H,2-7H2,1H3
InChIKeyAJLGKQNIZPNYIG-UHFFFAOYSA-N
MW236.33 g/mol
LogP4.14
Rot. Bonds2

About cycloheptyl-(3-fluoro-5-methylphenyl)methanol

cycloheptyl-(3-fluoro-5-methylphenyl)methanol (PubChem CID 79703242) has the molecular formula C15H21FO and a molecular weight of 236.33 g/mol. Its IUPAC name is cycloheptyl-(3-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Namecycloheptyl-(3-fluoro-5-methylphenyl)methanol
PubChem CID79703242
Molecular FormulaC15H21FO
Molecular Weight236.33 g/mol
Exact Mass236.16
IUPAC Namecycloheptyl-(3-fluoro-5-methylphenyl)methanol
SMILESCc1cc(F)cc(C(O)C2CCCCCC2)c1
InChIInChI=1S/C15H21FO/c1-11-8-13(10-14(16)9-11)15(17)12-6-4-2-3-5-7-12/h8-10,12,15,17H,2-7H2,1H3
InChIKeyAJLGKQNIZPNYIG-UHFFFAOYSA-N
XLogP4.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cycloheptyl-(3,5-dimethylphenyl)methanol
CID 65399155
(4,4-difluorocyclohexyl)-(3-fluoro-5-methylphenyl)methanol
CID 105116100
(3-bromo-5-fluorophenyl)-cyclohexylmethanol
CID 66425421
(R)-cyclobutyl-(3-fluoro-5-methylphenyl)methanamine
CID 130054445
cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 115351164
[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105232121
cyclopentyl-(4-fluoro-3-methylphenyl)methanol
CID 60929105
1-cyclobutyl-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79705578
N-[cyclopentyl-(3-fluoro-5-methylphenyl)methyl]ethanamine
CID 79704680
(3-fluoro-5-methylphenyl)-(5-methyloxolan-2-yl)methanol
CID 82837227
2-cyclohexyl-1-(3-fluoro-5-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771626
(S)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184621

Frequently Asked Questions

What is the IUPAC name of cycloheptyl-(3-fluoro-5-methylphenyl)methanol?
The IUPAC name of cycloheptyl-(3-fluoro-5-methylphenyl)methanol (CID 79703242) is cycloheptyl-(3-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for cycloheptyl-(3-fluoro-5-methylphenyl)methanol?
The canonical SMILES for cycloheptyl-(3-fluoro-5-methylphenyl)methanol is Cc1cc(F)cc(C(O)C2CCCCCC2)c1.
What is the InChIKey of cycloheptyl-(3-fluoro-5-methylphenyl)methanol?
The InChIKey is AJLGKQNIZPNYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FO/c1-11-8-13(10-14(16)9-11)15(17)12-6-4-2-3-5-7-12/h8-10,12,15,17H,2-7H2,1H3.
What are the key properties of cycloheptyl-(3-fluoro-5-methylphenyl)methanol?
cycloheptyl-(3-fluoro-5-methylphenyl)methanol has a molecular weight of 236.33 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl-(3-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 79703242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).