2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine

C16H24FNO — CID 102876314

IUPAC2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine
SMILESCCC1CCCCC1NCc1ccc(OC)cc1F
InChIInChI=1S/C16H24FNO/c1-3-12-6-4-5-7-16(12)18-11-13-8-9-14(19-2)10-15(13)17/h8-10,12,16,18H,3-7,11H2,1-2H3
InChIKeyQGJJAAVNZCCXSH-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.89
Rot. Bonds5

About 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine

2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine (PubChem CID 102876314) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine
PubChem CID102876314
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine
SMILESCCC1CCCCC1NCc1ccc(OC)cc1F
InChIInChI=1S/C16H24FNO/c1-3-12-6-4-5-7-16(12)18-11-13-8-9-14(19-2)10-15(13)17/h8-10,12,16,18H,3-7,11H2,1-2H3
InChIKeyQGJJAAVNZCCXSH-UHFFFAOYSA-N
XLogP3.89
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine 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

N-[(2-fluoro-4-methoxyphenyl)methyl]-2-methylcycloheptan-1-amine
CID 102876472
N-[(2,5-difluorophenyl)methyl]-2-ethylcyclohexan-1-amine
CID 43709240
2-ethyl-N-[(3-methoxyphenyl)methyl]cyclopentan-1-amine
CID 115691352
N-[(2-fluoro-4-methoxyphenyl)methyl]-4-methylcyclohexan-1-amine
CID 83310423
trans-(1S,2R)-2-ethyl-N-[(2-methoxyphenyl)methyl]cyclohexan-1-amine
CID 93046208
3-[(2-fluoro-4-methoxyphenyl)methylamino]cyclobutan-1-ol
CID 102876481
1-(4-ethylcyclohexyl)-N-[(2-fluoro-4-methoxyphenyl)methyl]methanamine
CID 102876292
N-[(2-fluoro-4-methoxyphenyl)methyl]-3-methylcyclohexan-1-amine
CID 103757549
[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol
CID 103700479
2-(chloromethyl)-N-[(2,4-difluorophenyl)methyl]cyclohexan-1-amine
CID 106365303
2-[[(2-ethylcyclohexyl)amino]methyl]-4-fluorophenol
CID 103948073
5-methoxy-2-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]phenol
CID 61263630

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine (CID 102876314) is 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine is CCC1CCCCC1NCc1ccc(OC)cc1F.
What is the InChIKey of 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine?
The InChIKey is QGJJAAVNZCCXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-3-12-6-4-5-7-16(12)18-11-13-8-9-14(19-2)10-15(13)17/h8-10,12,16,18H,3-7,11H2,1-2H3.
What are the key properties of 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine?
2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine has a molecular weight of 265.37 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 102876314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).