2-aminopropan-1-ol;2-(methylamino)ethanol

C6H18N2O2 — CID 159701933

IUPAC2-aminopropan-1-ol;2-(methylamino)ethanol
SMILESCC(N)CO.CNCCO
InChIInChI=1S/2C3H9NO/c1-4-2-3-5;1-3(4)2-5/h4-5H,2-3H2,1H3;3,5H,2,4H2,1H3
InChIKeyMXSPKLKQTXHOSD-UHFFFAOYSA-N
MW150.22 g/mol
LogP-1.48
Rot. Bonds3

About 2-aminopropan-1-ol;2-(methylamino)ethanol

2-aminopropan-1-ol;2-(methylamino)ethanol (PubChem CID 159701933) has the molecular formula C6H18N2O2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-aminopropan-1-ol;2-(methylamino)ethanol.

Molecular Properties

Compound Name2-aminopropan-1-ol;2-(methylamino)ethanol
PubChem CID159701933
Molecular FormulaC6H18N2O2
Molecular Weight150.22 g/mol
Exact Mass150.14
IUPAC Name2-aminopropan-1-ol;2-(methylamino)ethanol
SMILESCC(N)CO.CNCCO
InChIInChI=1S/2C3H9NO/c1-4-2-3-5;1-3(4)2-5/h4-5H,2-3H2,1H3;3,5H,2,4H2,1H3
InChIKeyMXSPKLKQTXHOSD-UHFFFAOYSA-N
XLogP-1.48
TPSA78.51 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 5-1.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 59962769
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2-aminopropan-1-ol;hydrofluoride
CID 22617394
hexane-1,6-diol;2-(methylamino)ethanol
CID 18353571
dioxotitanium;2-(methylamino)ethanol
CID 174872921
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dichlorozirconium;2-(methylamino)ethanol
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CID 88596466
2-(methylamino)ethanol;oxalic acid
CID 11506516
2-(2-aminoethylamino)ethanol;2-(methylamino)ethanol
CID 88701366
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Frequently Asked Questions

What is the IUPAC name of 2-aminopropan-1-ol;2-(methylamino)ethanol?
The IUPAC name of 2-aminopropan-1-ol;2-(methylamino)ethanol (CID 159701933) is 2-aminopropan-1-ol;2-(methylamino)ethanol.
What is the SMILES notation for 2-aminopropan-1-ol;2-(methylamino)ethanol?
The canonical SMILES for 2-aminopropan-1-ol;2-(methylamino)ethanol is CC(N)CO.CNCCO.
What is the InChIKey of 2-aminopropan-1-ol;2-(methylamino)ethanol?
The InChIKey is MXSPKLKQTXHOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H9NO/c1-4-2-3-5;1-3(4)2-5/h4-5H,2-3H2,1H3;3,5H,2,4H2,1H3.
What are the key properties of 2-aminopropan-1-ol;2-(methylamino)ethanol?
2-aminopropan-1-ol;2-(methylamino)ethanol has a molecular weight of 150.22 g/mol, XLogP of -1.48, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopropan-1-ol;2-(methylamino)ethanol is sourced from PubChem (CID 159701933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).