carbonic acid;2-(methylamino)ethanol

C4H11NO4 — CID 87131288

IUPACcarbonic acid;2-(methylamino)ethanol
SMILESCNCCO.O=C(O)O
InChIInChI=1S/C3H9NO.CH2O3/c1-4-2-3-5;2-1(3)4/h4-5H,2-3H2,1H3;(H2,2,3,4)
InChIKeyUWXFEGSTKRZNRU-UHFFFAOYSA-N
MW137.14 g/mol
LogP-0.58
Rot. Bonds2

About carbonic acid;2-(methylamino)ethanol

carbonic acid;2-(methylamino)ethanol (PubChem CID 87131288) has the molecular formula C4H11NO4 and a molecular weight of 137.14 g/mol. Its IUPAC name is carbonic acid;2-(methylamino)ethanol.

Molecular Properties

Compound Namecarbonic acid;2-(methylamino)ethanol
PubChem CID87131288
Molecular FormulaC4H11NO4
Molecular Weight137.14 g/mol
Exact Mass137.07
IUPAC Namecarbonic acid;2-(methylamino)ethanol
SMILESCNCCO.O=C(O)O
InChIInChI=1S/C3H9NO.CH2O3/c1-4-2-3-5;2-1(3)4/h4-5H,2-3H2,1H3;(H2,2,3,4)
InChIKeyUWXFEGSTKRZNRU-UHFFFAOYSA-N
XLogP-0.58
TPSA89.79 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)ethanol;oxalic acid
CID 11506516
2-(methylamino)ethanol;nobelium
CID 59962769
2-(methylamino)ethanol;platinum
CID 174353574
methane;2-(methylamino)ethanol
CID 158004537
2-(methylamino)ethanol;2,2,2-trifluoroacetic acid
CID 173051239
dioxotitanium;2-(methylamino)ethanol
CID 174872921
bis(2-(methylamino)ethanol);nickel(2+);diacetate
CID 158242939
bis(dihydroxy(oxo)phosphanium);2-(methylamino)ethanol
CID 88596466
azane;2-(methylamino)ethanol;sulfuric acid
CID 175379230
2-(methylamino)ethanol;2,2,3,3,3-pentafluoropropanoic acid
CID 86076103
hexane-1,6-diol;2-(methylamino)ethanol
CID 18353571
dichlorozirconium;2-(methylamino)ethanol
CID 174434300

Frequently Asked Questions

What is the IUPAC name of carbonic acid;2-(methylamino)ethanol?
The IUPAC name of carbonic acid;2-(methylamino)ethanol (CID 87131288) is carbonic acid;2-(methylamino)ethanol.
What is the SMILES notation for carbonic acid;2-(methylamino)ethanol?
The canonical SMILES for carbonic acid;2-(methylamino)ethanol is CNCCO.O=C(O)O.
What is the InChIKey of carbonic acid;2-(methylamino)ethanol?
The InChIKey is UWXFEGSTKRZNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO.CH2O3/c1-4-2-3-5;2-1(3)4/h4-5H,2-3H2,1H3;(H2,2,3,4).
What are the key properties of carbonic acid;2-(methylamino)ethanol?
carbonic acid;2-(methylamino)ethanol has a molecular weight of 137.14 g/mol, XLogP of -0.58, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;2-(methylamino)ethanol is sourced from PubChem (CID 87131288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).