carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)

C10H26N2O10 — CID 163568127

IUPACcarbonic acid;bis(2-(2-hydroxyethylamino)ethanol)
SMILESO=C(O)O.O=C(O)O.OCCNCCO.OCCNCCO
InChIInChI=1S/2C4H11NO2.2CH2O3/c2*6-3-1-5-2-4-7;2*2-1(3)4/h2*5-7H,1-4H2;2*(H2,2,3,4)
InChIKeyFWYIQBDZXBZOOV-UHFFFAOYSA-N
MW334.32 g/mol
LogP-2.43
Rot. Bonds8

About carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)

carbonic acid;bis(2-(2-hydroxyethylamino)ethanol) (PubChem CID 163568127) has the molecular formula C10H26N2O10 and a molecular weight of 334.32 g/mol. Its IUPAC name is carbonic acid;bis(2-(2-hydroxyethylamino)ethanol).

Molecular Properties

Compound Namecarbonic acid;bis(2-(2-hydroxyethylamino)ethanol)
PubChem CID163568127
Molecular FormulaC10H26N2O10
Molecular Weight334.32 g/mol
Exact Mass334.16
IUPAC Namecarbonic acid;bis(2-(2-hydroxyethylamino)ethanol)
SMILESO=C(O)O.O=C(O)O.OCCNCCO.OCCNCCO
InChIInChI=1S/2C4H11NO2.2CH2O3/c2*6-3-1-5-2-4-7;2*2-1(3)4/h2*5-7H,1-4H2;2*(H2,2,3,4)
InChIKeyFWYIQBDZXBZOOV-UHFFFAOYSA-N
XLogP-2.43
TPSA220.04 Ų
H-Bond Donors10
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.32
LogP ≤ 5-2.43
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

but-2-enedioic acid;bis(2-(2-hydroxyethylamino)ethanol)
CID 173323087
2-(2-hydroxyethylamino)ethanol;propanoic acid
CID 161172891
CID 172719967
CID 172719967
2-(2-hydroxyethylamino)ethanol;sulfur dioxide
CID 6454530
2-[2-(2-hydroxyethylamino)ethylamino]ethanol;dihydrochloride
CID 87137347
2-(2-hydroxyethylamino)ethanol;terephthalic acid
CID 70636860
acetic acid;2-(2-aminoethylamino)ethanol
CID 87485806
2-(2-hydroxyethylamino)ethyl hydrogen carbonate
CID 23179916
2-(2-hydroxyethylamino)acetic acid;phosphane
CID 174633538
sodium 2-(2-hydroxyethylamino)acetic acid
CID 22056559
2-(2-hydroxyethylamino)ethanol;propane
CID 142274456
6-(2-hydroxyethylamino)hexylcarbamic acid
CID 18423740

Frequently Asked Questions

What is the IUPAC name of carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)?
The IUPAC name of carbonic acid;bis(2-(2-hydroxyethylamino)ethanol) (CID 163568127) is carbonic acid;bis(2-(2-hydroxyethylamino)ethanol).
What is the SMILES notation for carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)?
The canonical SMILES for carbonic acid;bis(2-(2-hydroxyethylamino)ethanol) is O=C(O)O.O=C(O)O.OCCNCCO.OCCNCCO.
What is the InChIKey of carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)?
The InChIKey is FWYIQBDZXBZOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H11NO2.2CH2O3/c2*6-3-1-5-2-4-7;2*2-1(3)4/h2*5-7H,1-4H2;2*(H2,2,3,4).
What are the key properties of carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)?
carbonic acid;bis(2-(2-hydroxyethylamino)ethanol) has a molecular weight of 334.32 g/mol, XLogP of -2.43, 8 rotatable bonds, 10 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;bis(2-(2-hydroxyethylamino)ethanol) is sourced from PubChem (CID 163568127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).