[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine

C15H22FN — CID 105376265

IUPAC[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine
SMILESCc1ccc(F)cc1CC1CCCCC1CN
InChIInChI=1S/C15H22FN/c1-11-6-7-15(16)9-14(11)8-12-4-2-3-5-13(12)10-17/h6-7,9,12-13H,2-5,8,10,17H2,1H3
InChIKeyJRCXNWYJLNLQTP-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.44
Rot. Bonds3

About [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine

[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine (PubChem CID 105376265) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine
PubChem CID105376265
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Name[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine
SMILESCc1ccc(F)cc1CC1CCCCC1CN
InChIInChI=1S/C15H22FN/c1-11-6-7-15(16)9-14(11)8-12-4-2-3-5-13(12)10-17/h6-7,9,12-13H,2-5,8,10,17H2,1H3
InChIKeyJRCXNWYJLNLQTP-UHFFFAOYSA-N
XLogP3.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-[(4-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine
CID 114350126
N-[[2-[(5-fluoro-2-methylphenyl)methyl]cycloheptyl]methyl]propan-2-amine
CID 105376313
N-ethyl-2-[(5-fluoro-2-methylphenyl)methyl]cyclohexan-1-amine
CID 105372322
3-[(5-fluoro-2-methylphenyl)methyl]-2-methylcyclopentan-1-amine
CID 105375553
[2-[(2-chloro-4-fluorophenyl)methyl]cyclopentyl]methanamine
CID 81010671
2-tert-butyl-1-[(5-fluoro-2-methylphenyl)methyl]cyclohexan-1-amine
CID 105373066
3-[(5-fluoro-2-methylphenyl)methyl]-N-propylcycloheptan-1-amine
CID 105375525
1-chloro-2-[(4-fluoro-2-methylphenyl)methyl]cycloheptane
CID 114348646
1-cycloheptyl-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373996
N-[[2-[(4-fluoro-2-methylphenyl)methyl]cycloheptyl]methyl]propan-2-amine
CID 114350172
[2-[(2,3-difluorophenyl)methyl]cycloheptyl]methanamine
CID 81010182
2-[(2-chloro-5-fluorophenyl)methyl]cyclohexan-1-amine
CID 102616731

Frequently Asked Questions

What is the IUPAC name of [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine?
The IUPAC name of [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine (CID 105376265) is [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine.
What is the SMILES notation for [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine?
The canonical SMILES for [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine is Cc1ccc(F)cc1CC1CCCCC1CN.
What is the InChIKey of [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine?
The InChIKey is JRCXNWYJLNLQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-11-6-7-15(16)9-14(11)8-12-4-2-3-5-13(12)10-17/h6-7,9,12-13H,2-5,8,10,17H2,1H3.
What are the key properties of [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine?
[2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine has a molecular weight of 235.35 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-fluoro-2-methylphenyl)methyl]cyclohexyl]methanamine is sourced from PubChem (CID 105376265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).