methane;2-(methylamino)ethanol

C4H13NO — CID 158004537

IUPACmethane;2-(methylamino)ethanol
SMILESC.CNCCO
InChIInChI=1S/C3H9NO.CH4/c1-4-2-3-5;/h4-5H,2-3H2,1H3;1H4
InChIKeyFECYOSYUOCOUHI-UHFFFAOYSA-N
MW91.15 g/mol
LogP-0.17
Rot. Bonds2

About methane;2-(methylamino)ethanol

methane;2-(methylamino)ethanol (PubChem CID 158004537) has the molecular formula C4H13NO and a molecular weight of 91.15 g/mol. Its IUPAC name is methane;2-(methylamino)ethanol.

Molecular Properties

Compound Namemethane;2-(methylamino)ethanol
PubChem CID158004537
Molecular FormulaC4H13NO
Molecular Weight91.15 g/mol
Exact Mass91.10
IUPAC Namemethane;2-(methylamino)ethanol
SMILESC.CNCCO
InChIInChI=1S/C3H9NO.CH4/c1-4-2-3-5;/h4-5H,2-3H2,1H3;1H4
InChIKeyFECYOSYUOCOUHI-UHFFFAOYSA-N
XLogP-0.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.15
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 59962769
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dioxotitanium;2-(methylamino)ethanol
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dichlorozirconium;2-(methylamino)ethanol
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2-(methylamino)ethanol;oxalic acid
CID 11506516
bis(dihydroxy(oxo)phosphanium);2-(methylamino)ethanol
CID 88596466
azane;2-(methylamino)ethanol;sulfuric acid
CID 175379230
2-aminopropan-1-ol;2-(methylamino)ethanol
CID 159701933
bis(2-(methylamino)ethanol);nickel(2+);diacetate
CID 158242939
2-(2-aminoethylamino)ethanol;2-(methylamino)ethanol
CID 88701366

Frequently Asked Questions

What is the IUPAC name of methane;2-(methylamino)ethanol?
The IUPAC name of methane;2-(methylamino)ethanol (CID 158004537) is methane;2-(methylamino)ethanol.
What is the SMILES notation for methane;2-(methylamino)ethanol?
The canonical SMILES for methane;2-(methylamino)ethanol is C.CNCCO.
What is the InChIKey of methane;2-(methylamino)ethanol?
The InChIKey is FECYOSYUOCOUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO.CH4/c1-4-2-3-5;/h4-5H,2-3H2,1H3;1H4.
What are the key properties of methane;2-(methylamino)ethanol?
methane;2-(methylamino)ethanol has a molecular weight of 91.15 g/mol, XLogP of -0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-(methylamino)ethanol is sourced from PubChem (CID 158004537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).