5-(3-fluoropropylamino)pentan-1-ol

C8H18FNO — CID 107317265

IUPAC5-(3-fluoropropylamino)pentan-1-ol
SMILESOCCCCCNCCCF
InChIInChI=1S/C8H18FNO/c9-5-4-7-10-6-2-1-3-8-11/h10-11H,1-8H2
InChIKeyQHYGUSWFHNDALK-UHFFFAOYSA-N
MW163.24 g/mol
LogP1.10
Rot. Bonds8

About 5-(3-fluoropropylamino)pentan-1-ol

5-(3-fluoropropylamino)pentan-1-ol (PubChem CID 107317265) has the molecular formula C8H18FNO and a molecular weight of 163.24 g/mol. Its IUPAC name is 5-(3-fluoropropylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(3-fluoropropylamino)pentan-1-ol
PubChem CID107317265
Molecular FormulaC8H18FNO
Molecular Weight163.24 g/mol
Exact Mass163.14
IUPAC Name5-(3-fluoropropylamino)pentan-1-ol
SMILESOCCCCCNCCCF
InChIInChI=1S/C8H18FNO/c9-5-4-7-10-6-2-1-3-8-11/h10-11H,1-8H2
InChIKeyQHYGUSWFHNDALK-UHFFFAOYSA-N
XLogP1.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoropropylamino)pentan-1-ol?
The IUPAC name of 5-(3-fluoropropylamino)pentan-1-ol (CID 107317265) is 5-(3-fluoropropylamino)pentan-1-ol.
What is the SMILES notation for 5-(3-fluoropropylamino)pentan-1-ol?
The canonical SMILES for 5-(3-fluoropropylamino)pentan-1-ol is OCCCCCNCCCF.
What is the InChIKey of 5-(3-fluoropropylamino)pentan-1-ol?
The InChIKey is QHYGUSWFHNDALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FNO/c9-5-4-7-10-6-2-1-3-8-11/h10-11H,1-8H2.
What are the key properties of 5-(3-fluoropropylamino)pentan-1-ol?
5-(3-fluoropropylamino)pentan-1-ol has a molecular weight of 163.24 g/mol, XLogP of 1.10, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoropropylamino)pentan-1-ol is sourced from PubChem (CID 107317265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).