2-aminoethanol;ethane

C4H13NO — CID 90703907

IUPAC2-aminoethanol;ethane
SMILESCC.NCCO
InChIInChI=1S/C2H7NO.C2H6/c3-1-2-4;1-2/h4H,1-3H2;1-2H3
InChIKeyWBHNVPYYVCMEKV-UHFFFAOYSA-N
MW91.15 g/mol
LogP-0.04
Rot. Bonds1

About 2-aminoethanol;ethane

2-aminoethanol;ethane (PubChem CID 90703907) has the molecular formula C4H13NO and a molecular weight of 91.15 g/mol. Its IUPAC name is 2-aminoethanol;ethane.

Molecular Properties

Compound Name2-aminoethanol;ethane
PubChem CID90703907
Molecular FormulaC4H13NO
Molecular Weight91.15 g/mol
Exact Mass91.10
IUPAC Name2-aminoethanol;ethane
SMILESCC.NCCO
InChIInChI=1S/C2H7NO.C2H6/c3-1-2-4;1-2/h4H,1-3H2;1-2H3
InChIKeyWBHNVPYYVCMEKV-UHFFFAOYSA-N
XLogP-0.04
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.15
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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sodium 2-aminoethanol
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2-aminoethanol;N,N-dimethylmethanamine
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lithium;2-aminoethanol;chloride
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CID 88757249
CID 88757249
2-aminoethanol;azane;trihydrate
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2-aminoethanol;platinum;hexahydroxide
CID 14818797

Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;ethane?
The IUPAC name of 2-aminoethanol;ethane (CID 90703907) is 2-aminoethanol;ethane.
What is the SMILES notation for 2-aminoethanol;ethane?
The canonical SMILES for 2-aminoethanol;ethane is CC.NCCO.
What is the InChIKey of 2-aminoethanol;ethane?
The InChIKey is WBHNVPYYVCMEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO.C2H6/c3-1-2-4;1-2/h4H,1-3H2;1-2H3.
What are the key properties of 2-aminoethanol;ethane?
2-aminoethanol;ethane has a molecular weight of 91.15 g/mol, XLogP of -0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;ethane is sourced from PubChem (CID 90703907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).