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

C15H24FNO — CID 63937972

IUPAC5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine
SMILESCCCNCCCCCOCc1ccccc1F
InChIInChI=1S/C15H24FNO/c1-2-10-17-11-6-3-7-12-18-13-14-8-4-5-9-15(14)16/h4-5,8-9,17H,2-3,6-7,10-13H2,1H3
InChIKeyVBOOOUGWMPZXKB-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.51
Rot. Bonds10

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

5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine (PubChem CID 63937972) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine
PubChem CID63937972
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine
SMILESCCCNCCCCCOCc1ccccc1F
InChIInChI=1S/C15H24FNO/c1-2-10-17-11-6-3-7-12-18-13-14-8-4-5-9-15(14)16/h4-5,8-9,17H,2-3,6-7,10-13H2,1H3
InChIKeyVBOOOUGWMPZXKB-UHFFFAOYSA-N
XLogP3.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.51
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

4-(2-fluorophenoxy)-N-propylbutan-1-amine
CID 62452469
N-[4-[(2-fluorophenyl)methoxy]butyl]cyclopropanamine
CID 63935145
N-[[2-(pentoxymethyl)phenyl]methyl]propan-1-amine
CID 62449906
1-[(2-fluorophenyl)methoxy]-3-(propylamino)propan-2-ol
CID 60634200
N-[(2-fluorophenyl)methyl]hexadecan-1-amine
CID 54795853
N-[2-(2-fluorophenyl)ethyl]pentan-1-amine
CID 28576989
N-[(2-fluorophenyl)methyl]octan-1-amine
CID 4722837
ethane;N-[2-(2-fluorophenyl)ethyl]propan-1-amine
CID 155737133
3-[(2-fluorophenyl)methoxy]propan-1-ol
CID 23325115
5-(furan-2-ylmethoxy)-N-propylpentan-1-amine
CID 62445042
N-[[4-fluoro-3-(pentoxymethyl)phenyl]methyl]propan-1-amine
CID 107457179
N-[2-[(2-fluorophenyl)methoxy]ethyl]pentan-3-amine
CID 63937396

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine?
The IUPAC name of 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine (CID 63937972) is 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine.
What is the SMILES notation for 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine?
The canonical SMILES for 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine is CCCNCCCCCOCc1ccccc1F.
What is the InChIKey of 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine?
The InChIKey is VBOOOUGWMPZXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-2-10-17-11-6-3-7-12-18-13-14-8-4-5-9-15(14)16/h4-5,8-9,17H,2-3,6-7,10-13H2,1H3.
What are the key properties of 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine?
5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine has a molecular weight of 253.36 g/mol, XLogP of 3.51, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine is sourced from PubChem (CID 63937972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).