8-amino-1-ethoxyoctan-1-ol

C10H23NO2 — CID 89136202

IUPAC8-amino-1-ethoxyoctan-1-ol
SMILESCCOC(O)CCCCCCCN
InChIInChI=1S/C10H23NO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h10,12H,2-9,11H2,1H3
InChIKeyXDWPJDZMFXGETH-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.64
Rot. Bonds9

About 8-amino-1-ethoxyoctan-1-ol

8-amino-1-ethoxyoctan-1-ol (PubChem CID 89136202) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 8-amino-1-ethoxyoctan-1-ol.

Molecular Properties

Compound Name8-amino-1-ethoxyoctan-1-ol
PubChem CID89136202
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name8-amino-1-ethoxyoctan-1-ol
SMILESCCOC(O)CCCCCCCN
InChIInChI=1S/C10H23NO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h10,12H,2-9,11H2,1H3
InChIKeyXDWPJDZMFXGETH-UHFFFAOYSA-N
XLogP1.64
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

3-amino-1-pentoxypropan-1-ol;pentan-1-amine
CID 88847262
1-aminooctacosan-11-ol
CID 172994921
2-(2-aminoethylamino)-1-ethoxyethanol
CID 57110947
14-aminotetradecane-1,1-diol
CID 87370531
(8S)-nonane-1,8-diamine
CID 87205838
decane-1,9-diamine
CID 23448369
1,6-diaminohexan-1-ol
CID 57008257
undecane-1,10-diamine
CID 140782210
8-aminooctan-4-ol
CID 146035755
1-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]tridecan-1-ol
CID 175685028
4-amino-1-aminooxybutan-1-ol
CID 173339866
12-ethyltetradecan-1-amine
CID 87456130

Frequently Asked Questions

What is the IUPAC name of 8-amino-1-ethoxyoctan-1-ol?
The IUPAC name of 8-amino-1-ethoxyoctan-1-ol (CID 89136202) is 8-amino-1-ethoxyoctan-1-ol.
What is the SMILES notation for 8-amino-1-ethoxyoctan-1-ol?
The canonical SMILES for 8-amino-1-ethoxyoctan-1-ol is CCOC(O)CCCCCCCN.
What is the InChIKey of 8-amino-1-ethoxyoctan-1-ol?
The InChIKey is XDWPJDZMFXGETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h10,12H,2-9,11H2,1H3.
What are the key properties of 8-amino-1-ethoxyoctan-1-ol?
8-amino-1-ethoxyoctan-1-ol has a molecular weight of 189.30 g/mol, XLogP of 1.64, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-1-ethoxyoctan-1-ol is sourced from PubChem (CID 89136202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).