8-aminooctan-4-ol

C8H19NO — CID 146035755

IUPAC8-aminooctan-4-ol
SMILESCCCC(O)CCCCN
InChIInChI=1S/C8H19NO/c1-2-5-8(10)6-3-4-7-9/h8,10H,2-7,9H2,1H3
InChIKeyFGBXVVMARDLGQU-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.28
Rot. Bonds6

About 8-aminooctan-4-ol

8-aminooctan-4-ol (PubChem CID 146035755) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 8-aminooctan-4-ol.

Molecular Properties

Compound Name8-aminooctan-4-ol
PubChem CID146035755
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name8-aminooctan-4-ol
SMILESCCCC(O)CCCCN
InChIInChI=1S/C8H19NO/c1-2-5-8(10)6-3-4-7-9/h8,10H,2-7,9H2,1H3
InChIKeyFGBXVVMARDLGQU-UHFFFAOYSA-N
XLogP1.28
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.28
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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Related Compounds

1-aminooctacosan-11-ol
CID 172994921
1-aminopentadecan-4-ol
CID 151480186
(4R,8R)-undecane-4,8-diol
CID 101372142
1-aminooctan-3-ol
CID 21436343
(3R)-1-aminooctan-3-ol
CID 22797502
(4S)-nonadecan-4-ol
CID 89325355
octacosan-4-ol
CID 54117167
8-aminooctane-1,4-diol
CID 123424341
1,1-diaminoicosane-4,17-diol
CID 87384635
tetradecane-1,11-diol
CID 11390599
nonacosane-7,20-diol
CID 174949468
tetracosan-6-ol
CID 154265400

Frequently Asked Questions

What is the IUPAC name of 8-aminooctan-4-ol?
The IUPAC name of 8-aminooctan-4-ol (CID 146035755) is 8-aminooctan-4-ol.
What is the SMILES notation for 8-aminooctan-4-ol?
The canonical SMILES for 8-aminooctan-4-ol is CCCC(O)CCCCN.
What is the InChIKey of 8-aminooctan-4-ol?
The InChIKey is FGBXVVMARDLGQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-2-5-8(10)6-3-4-7-9/h8,10H,2-7,9H2,1H3.
What are the key properties of 8-aminooctan-4-ol?
8-aminooctan-4-ol has a molecular weight of 145.25 g/mol, XLogP of 1.28, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-aminooctan-4-ol is sourced from PubChem (CID 146035755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).