2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine

C15H24FNO — CID 79439292

IUPAC2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine
SMILESCCCNCC(CCCOC)c1ccccc1F
InChIInChI=1S/C15H24FNO/c1-3-10-17-12-13(7-6-11-18-2)14-8-4-5-9-15(14)16/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3
InChIKeyMUZDZSOMYRFKCU-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.34
Rot. Bonds9

About 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine

2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine (PubChem CID 79439292) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine
PubChem CID79439292
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine
SMILESCCCNCC(CCCOC)c1ccccc1F
InChIInChI=1S/C15H24FNO/c1-3-10-17-12-13(7-6-11-18-2)14-8-4-5-9-15(14)16/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3
InChIKeyMUZDZSOMYRFKCU-UHFFFAOYSA-N
XLogP3.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-(2-fluorophenyl)-5-(2-methoxyethoxy)pentan-1-amine
CID 103412646
2-(2-bromophenyl)-6-methoxy-N-propylhexan-1-amine
CID 104649517
2-(2-fluorophenyl)-4-(2-methoxyethoxy)-N-(2-methoxyethyl)butan-1-amine
CID 79436793
3-ethoxy-2-(2-fluorophenyl)-N-propylpropan-1-amine
CID 103984843
2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine
CID 79449341
4-butoxy-N-ethyl-2-(2-fluorophenyl)butan-1-amine
CID 79439765
2-(2-fluorophenyl)-N-methyldodecan-1-amine
CID 79435505
2-(2-fluorophenyl)-6-methoxyhexan-1-amine
CID 104649507
2-(2-bromophenyl)-5-ethoxy-N-propylpentan-1-amine
CID 79449363
4-(2-methoxyethoxy)-2-(2-methylphenyl)-N-propylbutan-1-amine
CID 79421909
5-methoxy-2-(3-methylphenyl)-N-propylpentan-1-amine
CID 79417297
2-(2-chlorophenyl)-5-ethoxy-N-propylpentan-1-amine
CID 79448818

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine?
The IUPAC name of 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine (CID 79439292) is 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine.
What is the SMILES notation for 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine?
The canonical SMILES for 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine is CCCNCC(CCCOC)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine?
The InChIKey is MUZDZSOMYRFKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-3-10-17-12-13(7-6-11-18-2)14-8-4-5-9-15(14)16/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine?
2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine has a molecular weight of 253.36 g/mol, XLogP of 3.34, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine is sourced from PubChem (CID 79439292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).