azane;2-(2-hydroxyethoxy)-1-methoxyethanol

C5H15NO4 — CID 90384460

IUPACazane;2-(2-hydroxyethoxy)-1-methoxyethanol
SMILESCOC(O)COCCO.N
InChIInChI=1S/C5H12O4.H3N/c1-8-5(7)4-9-3-2-6;/h5-7H,2-4H2,1H3;1H3
InChIKeyFWXCQJPRJFYHAI-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.88
Rot. Bonds5

About azane;2-(2-hydroxyethoxy)-1-methoxyethanol

azane;2-(2-hydroxyethoxy)-1-methoxyethanol (PubChem CID 90384460) has the molecular formula C5H15NO4 and a molecular weight of 153.18 g/mol. Its IUPAC name is azane;2-(2-hydroxyethoxy)-1-methoxyethanol.

Molecular Properties

Compound Nameazane;2-(2-hydroxyethoxy)-1-methoxyethanol
PubChem CID90384460
Molecular FormulaC5H15NO4
Molecular Weight153.18 g/mol
Exact Mass153.10
IUPAC Nameazane;2-(2-hydroxyethoxy)-1-methoxyethanol
SMILESCOC(O)COCCO.N
InChIInChI=1S/C5H12O4.H3N/c1-8-5(7)4-9-3-2-6;/h5-7H,2-4H2,1H3;1H3
InChIKeyFWXCQJPRJFYHAI-UHFFFAOYSA-N
XLogP-0.88
TPSA93.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-[2-(2-hydroxyethoxy)ethoxy]-1-methoxyethanol;2-sulfanylacetic acid
CID 175590705
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-methoxyethanol;prop-2-enoic acid
CID 87255416
2-(2-hydroxyethoxy)-1-methoxyethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 22726121
2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-methoxyethanol;2-methylprop-2-enoic acid
CID 87255356
2-[2-(2-hydroxyethoxy)ethoxy]-1-methoxyethanol;oxirane-2-carboxylic acid
CID 88623730
1-(2-hydroxyethoxy)propan-2-ol
CID 19360868
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-3-methoxypropan-2-ol
CID 88655335
1-(2-ethoxyethoxy)-2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 151784602
[1-hydroxy-2-[2-(2-hydroxyethoxy)ethoxy]ethyl] acetate
CID 18377815
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
CID 86587580
2-(2-hydroxyethoxy)ethanol;1-[2-(2-hydroxyethoxy)ethoxy]propan-2-ol
CID 161004910
2-[2-[2-[2-[2-(2-amino-2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 90384666

Frequently Asked Questions

What is the IUPAC name of azane;2-(2-hydroxyethoxy)-1-methoxyethanol?
The IUPAC name of azane;2-(2-hydroxyethoxy)-1-methoxyethanol (CID 90384460) is azane;2-(2-hydroxyethoxy)-1-methoxyethanol.
What is the SMILES notation for azane;2-(2-hydroxyethoxy)-1-methoxyethanol?
The canonical SMILES for azane;2-(2-hydroxyethoxy)-1-methoxyethanol is COC(O)COCCO.N.
What is the InChIKey of azane;2-(2-hydroxyethoxy)-1-methoxyethanol?
The InChIKey is FWXCQJPRJFYHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O4.H3N/c1-8-5(7)4-9-3-2-6;/h5-7H,2-4H2,1H3;1H3.
What are the key properties of azane;2-(2-hydroxyethoxy)-1-methoxyethanol?
azane;2-(2-hydroxyethoxy)-1-methoxyethanol has a molecular weight of 153.18 g/mol, XLogP of -0.88, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-(2-hydroxyethoxy)-1-methoxyethanol is sourced from PubChem (CID 90384460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).