[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine

C14H20FNO — CID 82812472

IUPAC[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine
SMILESCOc1cccc(C2CCCCC2CN)c1F
InChIInChI=1S/C14H20FNO/c1-17-13-8-4-7-12(14(13)15)11-6-3-2-5-10(11)9-16/h4,7-8,10-11H,2-3,5-6,9,16H2,1H3
InChIKeyFYWCSRYDDGTHNA-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.07
Rot. Bonds3

About [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine

[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine (PubChem CID 82812472) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine
PubChem CID82812472
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine
SMILESCOc1cccc(C2CCCCC2CN)c1F
InChIInChI=1S/C14H20FNO/c1-17-13-8-4-7-12(14(13)15)11-6-3-2-5-10(11)9-16/h4,7-8,10-11H,2-3,5-6,9,16H2,1H3
InChIKeyFYWCSRYDDGTHNA-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-fluoro-3-methoxyphenyl)cycloheptyl]-N-methylmethanamine
CID 82811219
N-[[2-(2-fluoro-3-methoxyphenyl)cycloheptyl]methyl]propan-2-amine
CID 82791684
[2-(5-fluoro-2-methoxyphenyl)cyclohexyl]methanamine
CID 82782278
N-[[2-(2-fluoro-3-methoxyphenyl)cycloheptyl]methyl]propan-1-amine
CID 82791683
2-(2-fluoro-3-methoxyphenyl)cyclopentan-1-ol
CID 82812195
2-(2-fluoro-3-methoxyphenyl)-N-methylcyclopentan-1-amine
CID 82811854
[2-[2-(trifluoromethoxy)phenyl]cycloheptyl]methanamine
CID 81009543
[2-(3-fluoro-4-methoxyphenyl)cycloheptyl]methanamine
CID 81009542
[2-(4-methoxy-1,3-benzoxazol-2-yl)cyclohexyl]methanamine
CID 114764869
[2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 10443420
[(1S,2S)-2-(2,3-dimethoxyphenyl)cyclopropyl]methanamine
CID 94557662
[(1R,2R)-2-(2,3-dimethoxyphenyl)cyclopropyl]methanamine
CID 94557663

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine?
The IUPAC name of [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine (CID 82812472) is [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine.
What is the SMILES notation for [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine?
The canonical SMILES for [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine is COc1cccc(C2CCCCC2CN)c1F.
What is the InChIKey of [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine?
The InChIKey is FYWCSRYDDGTHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-17-13-8-4-7-12(14(13)15)11-6-3-2-5-10(11)9-16/h4,7-8,10-11H,2-3,5-6,9,16H2,1H3.
What are the key properties of [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine?
[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine has a molecular weight of 237.32 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine is sourced from PubChem (CID 82812472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).