(1R)-1-amino-6-fluorohexan-1-ol

C6H14FNO — CID 122643692

IUPAC(1R)-1-amino-6-fluorohexan-1-ol
SMILESN[C@H](O)CCCCCF
InChIInChI=1S/C6H14FNO/c7-5-3-1-2-4-6(8)9/h6,9H,1-5,8H2/t6-/m1/s1
InChIKeySBGDBROQXMEQBP-ZCFIWIBFSA-N
MW135.18 g/mol
LogP0.79
Rot. Bonds5

About (1R)-1-amino-6-fluorohexan-1-ol

(1R)-1-amino-6-fluorohexan-1-ol (PubChem CID 122643692) has the molecular formula C6H14FNO and a molecular weight of 135.18 g/mol. Its IUPAC name is (1R)-1-amino-6-fluorohexan-1-ol.

Molecular Properties

Compound Name(1R)-1-amino-6-fluorohexan-1-ol
PubChem CID122643692
Molecular FormulaC6H14FNO
Molecular Weight135.18 g/mol
Exact Mass135.11
IUPAC Name(1R)-1-amino-6-fluorohexan-1-ol
SMILESN[C@H](O)CCCCCF
InChIInChI=1S/C6H14FNO/c7-5-3-1-2-4-6(8)9/h6,9H,1-5,8H2/t6-/m1/s1
InChIKeySBGDBROQXMEQBP-ZCFIWIBFSA-N
XLogP0.79
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.18
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-amino-6-fluorohexan-1-ol?
The IUPAC name of (1R)-1-amino-6-fluorohexan-1-ol (CID 122643692) is (1R)-1-amino-6-fluorohexan-1-ol.
What is the SMILES notation for (1R)-1-amino-6-fluorohexan-1-ol?
The canonical SMILES for (1R)-1-amino-6-fluorohexan-1-ol is N[C@H](O)CCCCCF.
What is the InChIKey of (1R)-1-amino-6-fluorohexan-1-ol?
The InChIKey is SBGDBROQXMEQBP-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H14FNO/c7-5-3-1-2-4-6(8)9/h6,9H,1-5,8H2/t6-/m1/s1.
What are the key properties of (1R)-1-amino-6-fluorohexan-1-ol?
(1R)-1-amino-6-fluorohexan-1-ol has a molecular weight of 135.18 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-amino-6-fluorohexan-1-ol is sourced from PubChem (CID 122643692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).