N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine

C16H24FNO — CID 63934955

IUPACN-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine
SMILESCC1CCCCC1NCCOCc1ccccc1F
InChIInChI=1S/C16H24FNO/c1-13-6-2-5-9-16(13)18-10-11-19-12-14-7-3-4-8-15(14)17/h3-4,7-8,13,16,18H,2,5-6,9-12H2,1H3
InChIKeyUIXCSUCDXNBIQO-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.51
Rot. Bonds6

About N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine

N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine (PubChem CID 63934955) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine
PubChem CID63934955
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC NameN-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine
SMILESCC1CCCCC1NCCOCc1ccccc1F
InChIInChI=1S/C16H24FNO/c1-13-6-2-5-9-16(13)18-10-11-19-12-14-7-3-4-8-15(14)17/h3-4,7-8,13,16,18H,2,5-6,9-12H2,1H3
InChIKeyUIXCSUCDXNBIQO-UHFFFAOYSA-N
XLogP3.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-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-[4-[(2-fluorophenyl)methoxy]butyl]cyclopropanamine
CID 63935145
N-(dicyclopropylmethyl)-2-[(2-fluorophenyl)methoxy]ethanamine
CID 63937397
N-[(2,3-difluorophenyl)methyl]-2-methylcyclopentan-1-amine
CID 63277681
N-(2-ethoxyethyl)-2-methylcyclopentan-1-amine
CID 63278014
N-[2-(5-bromo-2-fluorophenoxy)ethyl]-2-methylcyclohexan-1-amine
CID 114677037
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylcycloheptan-1-amine
CID 104562465
(2R)-2-methyl-N-(2-phenylethyl)cyclohexan-1-amine
CID 70947263
N-[2-[(2-fluorophenyl)methoxy]ethyl]pentan-3-amine
CID 63937396
2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine
CID 43081283
N-[(2-chlorophenyl)methyl]-2-methylcyclohexan-1-amine
CID 43079937
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
N-benzyl-2-[(2-fluorophenyl)methoxy]ethanamine
CID 63936379

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine?
The IUPAC name of N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine (CID 63934955) is N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine.
What is the SMILES notation for N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine?
The canonical SMILES for N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine is CC1CCCCC1NCCOCc1ccccc1F.
What is the InChIKey of N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine?
The InChIKey is UIXCSUCDXNBIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-13-6-2-5-9-16(13)18-10-11-19-12-14-7-3-4-8-15(14)17/h3-4,7-8,13,16,18H,2,5-6,9-12H2,1H3.
What are the key properties of N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine?
N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine has a molecular weight of 265.37 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-fluorophenyl)methoxy]ethyl]-2-methylcyclohexan-1-amine is sourced from PubChem (CID 63934955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).