[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine

C15H21F2NO2 — CID 117459547

IUPAC[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine
SMILESCOc1cc(OC)c(F)c(C2(CN)CCCCC2)c1F
InChIInChI=1S/C15H21F2NO2/c1-19-10-8-11(20-2)14(17)12(13(10)16)15(9-18)6-4-3-5-7-15/h8H,3-7,9,18H2,1-2H3
InChIKeyUEBGVOXFKXFPQM-UHFFFAOYSA-N
MW285.33 g/mol
LogP3.14
Rot. Bonds4

About [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine

[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine (PubChem CID 117459547) has the molecular formula C15H21F2NO2 and a molecular weight of 285.33 g/mol. Its IUPAC name is [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine
PubChem CID117459547
Molecular FormulaC15H21F2NO2
Molecular Weight285.33 g/mol
Exact Mass285.15
IUPAC Name[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine
SMILESCOc1cc(OC)c(F)c(C2(CN)CCCCC2)c1F
InChIInChI=1S/C15H21F2NO2/c1-19-10-8-11(20-2)14(17)12(13(10)16)15(9-18)6-4-3-5-7-15/h8H,3-7,9,18H2,1-2H3
InChIKeyUEBGVOXFKXFPQM-UHFFFAOYSA-N
XLogP3.14
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(2-fluoro-3,6-dimethoxyphenyl)cyclopentyl]methanamine
CID 117386175
[1-(2-fluoro-6-methoxy-3-methylphenyl)cyclohexyl]methanamine
CID 117382107
[1-(2-fluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine
CID 117422005
[1-(2,5-difluoro-3-methoxyphenyl)cyclopentyl]methanamine
CID 117355086
3-[1-(aminomethyl)cyclohexyl]-2-fluoro-4,5-dimethoxyphenol
CID 117455550
[1-(3-chloro-2,6-difluoro-4-methoxyphenyl)cyclopentyl]methanamine
CID 117441409
[1-(2,6-difluoro-4-methoxyphenyl)cyclohexyl]methanamine
CID 117391281
[1-(2,3-difluoro-6-methoxyphenyl)cyclobutyl]methanamine
CID 117326701
2-[1-(aminomethyl)cyclopentyl]-4-chloro-3-fluoro-6-methoxyphenol
CID 117437146
2-[1-(aminomethyl)cyclohexyl]-3-chloro-4-fluoro-6-methoxyphenol
CID 117464477
[1-(2,3,6-trimethoxyphenyl)cyclopentyl]methanamine
CID 117417809
[1-(2,3-dimethoxy-5,6-dimethylphenyl)cyclohexyl]methanamine
CID 117444899

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine?
The IUPAC name of [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine (CID 117459547) is [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine is COc1cc(OC)c(F)c(C2(CN)CCCCC2)c1F.
What is the InChIKey of [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine?
The InChIKey is UEBGVOXFKXFPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F2NO2/c1-19-10-8-11(20-2)14(17)12(13(10)16)15(9-18)6-4-3-5-7-15/h8H,3-7,9,18H2,1-2H3.
What are the key properties of [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine?
[1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine has a molecular weight of 285.33 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-difluoro-3,5-dimethoxyphenyl)cyclohexyl]methanamine is sourced from PubChem (CID 117459547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).