1-[2-ethoxyethyl(methyl)amino]pentan-2-ol

C10H23NO2 — CID 81061715

IUPAC1-[2-ethoxyethyl(methyl)amino]pentan-2-ol
SMILESCCCC(O)CN(C)CCOCC
InChIInChI=1S/C10H23NO2/c1-4-6-10(12)9-11(3)7-8-13-5-2/h10,12H,4-9H2,1-3H3
InChIKeyYDYWLUULXNKTOP-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.12
Rot. Bonds8

About 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol

1-[2-ethoxyethyl(methyl)amino]pentan-2-ol (PubChem CID 81061715) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol.

Molecular Properties

Compound Name1-[2-ethoxyethyl(methyl)amino]pentan-2-ol
PubChem CID81061715
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name1-[2-ethoxyethyl(methyl)amino]pentan-2-ol
SMILESCCCC(O)CN(C)CCOCC
InChIInChI=1S/C10H23NO2/c1-4-6-10(12)9-11(3)7-8-13-5-2/h10,12H,4-9H2,1-3H3
InChIKeyYDYWLUULXNKTOP-UHFFFAOYSA-N
XLogP1.12
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-ethoxyethyl(methyl)amino]-3-methoxypropan-2-ol
CID 62013826
1-bromo-3-[2-ethoxyethyl(methyl)amino]propan-2-ol
CID 112561814
1-[methyl(propyl)amino]pentan-2-ol
CID 62042570
1-ethoxy-3-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 80710339
1-ethoxy-3-[2-hydroxyethyl(methyl)amino]propan-2-ol
CID 63934385
1-[2-(dimethylamino)ethyl-methylamino]-3-ethoxypropan-2-ol
CID 63932351
1-N-(2-ethoxyethyl)-1-N,3-dimethyl-2-N-propylbutane-1,2-diamine
CID 81058530
N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine
CID 81055341
1-N-(2-ethoxyethyl)-4-methoxy-1-N-methylbutane-1,2-diamine
CID 81056203
N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine
CID 104682346
1-ethoxypentan-2-ol
CID 21201051
3-[2-ethoxyethyl(methyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 76910844

Frequently Asked Questions

What is the IUPAC name of 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol?
The IUPAC name of 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol (CID 81061715) is 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol.
What is the SMILES notation for 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol?
The canonical SMILES for 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol is CCCC(O)CN(C)CCOCC.
What is the InChIKey of 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol?
The InChIKey is YDYWLUULXNKTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-4-6-10(12)9-11(3)7-8-13-5-2/h10,12H,4-9H2,1-3H3.
What are the key properties of 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol?
1-[2-ethoxyethyl(methyl)amino]pentan-2-ol has a molecular weight of 189.30 g/mol, XLogP of 1.12, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-ethoxyethyl(methyl)amino]pentan-2-ol is sourced from PubChem (CID 81061715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).