5-ethoxy-2-ethyl-2-methylpentan-1-ol

C10H22O2 — CID 66059379

IUPAC5-ethoxy-2-ethyl-2-methylpentan-1-ol
SMILESCCOCCCC(C)(CC)CO
InChIInChI=1S/C10H22O2/c1-4-10(3,9-11)7-6-8-12-5-2/h11H,4-9H2,1-3H3
InChIKeyDAVLLGAPXHAMNC-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.21
Rot. Bonds7

About 5-ethoxy-2-ethyl-2-methylpentan-1-ol

5-ethoxy-2-ethyl-2-methylpentan-1-ol (PubChem CID 66059379) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 5-ethoxy-2-ethyl-2-methylpentan-1-ol.

Molecular Properties

Compound Name5-ethoxy-2-ethyl-2-methylpentan-1-ol
PubChem CID66059379
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name5-ethoxy-2-ethyl-2-methylpentan-1-ol
SMILESCCOCCCC(C)(CC)CO
InChIInChI=1S/C10H22O2/c1-4-10(3,9-11)7-6-8-12-5-2/h11H,4-9H2,1-3H3
InChIKeyDAVLLGAPXHAMNC-UHFFFAOYSA-N
XLogP2.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.21
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

5-ethoxy-2-methyl-2-propylpentan-1-ol
CID 66026142
2-ethyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
CID 103415225
2,9-diethyl-2,9-dimethyldecane-1,10-diol
CID 3069679
2,11-diethyl-2,11-dimethyldodecane-1,12-diol
CID 3069683
1-ethoxy-4,4-dimethylhexane
CID 89037329
ethoxyethane;2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 21464807
2-ethyl-2-methyl-5-phenoxypentan-1-ol
CID 66059804
(2S)-2-ethyl-2-methylbutane-1,4-diol
CID 89138945
2-[2-[2-(hydroxymethyl)-2-methylbutoxy]ethoxymethyl]-2-methylbutan-1-ol;methane
CID 158118632
N-tert-butyl-5-ethoxy-2-methyl-2-propylpentan-1-amine
CID 65177873
4-amino-2-ethyl-2-methylbutan-1-ol
CID 105427654
5-ethoxy-N,2-dimethylpentan-2-amine
CID 135220051

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-ethyl-2-methylpentan-1-ol?
The IUPAC name of 5-ethoxy-2-ethyl-2-methylpentan-1-ol (CID 66059379) is 5-ethoxy-2-ethyl-2-methylpentan-1-ol.
What is the SMILES notation for 5-ethoxy-2-ethyl-2-methylpentan-1-ol?
The canonical SMILES for 5-ethoxy-2-ethyl-2-methylpentan-1-ol is CCOCCCC(C)(CC)CO.
What is the InChIKey of 5-ethoxy-2-ethyl-2-methylpentan-1-ol?
The InChIKey is DAVLLGAPXHAMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2/c1-4-10(3,9-11)7-6-8-12-5-2/h11H,4-9H2,1-3H3.
What are the key properties of 5-ethoxy-2-ethyl-2-methylpentan-1-ol?
5-ethoxy-2-ethyl-2-methylpentan-1-ol has a molecular weight of 174.28 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-ethyl-2-methylpentan-1-ol is sourced from PubChem (CID 66059379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).