1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol

C10H23NO4 — CID 60702644

IUPAC1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
SMILESCCONCC(O)COCCOC(C)C
InChIInChI=1S/C10H23NO4/c1-4-15-11-7-10(12)8-13-5-6-14-9(2)3/h9-12H,4-8H2,1-3H3
InChIKeyKJMUMHQMMKTMRA-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.33
Rot. Bonds10

About 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol

1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol (PubChem CID 60702644) has the molecular formula C10H23NO4 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol.

Molecular Properties

Compound Name1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
PubChem CID60702644
Molecular FormulaC10H23NO4
Molecular Weight221.30 g/mol
Exact Mass221.16
IUPAC Name1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
SMILESCCONCC(O)COCCOC(C)C
InChIInChI=1S/C10H23NO4/c1-4-15-11-7-10(12)8-13-5-6-14-9(2)3/h9-12H,4-8H2,1-3H3
InChIKeyKJMUMHQMMKTMRA-UHFFFAOYSA-N
XLogP0.33
TPSA59.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]amino]oxyacetamide
CID 112673643
1-(ethoxyamino)-3-(4-methylpentoxy)propan-2-ol
CID 60702220
1-(pent-1-yn-3-ylamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 114161170
1-[[1-(hydroxymethyl)cyclopentyl]amino]-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 62517581
3-[[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]amino]-2,2-dimethylpropanamide
CID 106276148
1-[[1-(hydroxymethyl)cyclopropyl]methylamino]-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 113313258
1-(1-methylsulfonylpropan-2-ylamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 64643205
1-(2-cyclopropylpropylamino)-3-(2-ethoxyethoxy)propan-2-ol
CID 113226892
2-[[[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]amino]methyl]phenol
CID 114331941
1-(4-propan-2-ylanilino)-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 60896578
1-[[2-hydroxy-3-(2-methoxyethoxy)propyl]amino]butan-2-ol
CID 106990539
(2S)-1-(propoxyamino)butan-2-ol
CID 131167807

Frequently Asked Questions

What is the IUPAC name of 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol?
The IUPAC name of 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol (CID 60702644) is 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol.
What is the SMILES notation for 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol?
The canonical SMILES for 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol is CCONCC(O)COCCOC(C)C.
What is the InChIKey of 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol?
The InChIKey is KJMUMHQMMKTMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO4/c1-4-15-11-7-10(12)8-13-5-6-14-9(2)3/h9-12H,4-8H2,1-3H3.
What are the key properties of 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol?
1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol has a molecular weight of 221.30 g/mol, XLogP of 0.33, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxyamino)-3-(2-propan-2-yloxyethoxy)propan-2-ol is sourced from PubChem (CID 60702644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).