ethanol;methanamine

C5H21N3O — CID 174381315

IUPACethanol;methanamine
SMILESCCO.CN.CN.CN
InChIInChI=1S/C2H6O.3CH5N/c1-2-3;3*1-2/h3H,2H2,1H3;3*2H2,1H3
InChIKeyYJUPMZFKYGLLLY-UHFFFAOYSA-N
MW139.24 g/mol
LogP-1.28
Rot. Bonds

About ethanol;methanamine

ethanol;methanamine (PubChem CID 174381315) has the molecular formula C5H21N3O and a molecular weight of 139.24 g/mol. Its IUPAC name is ethanol;methanamine.

Molecular Properties

Compound Nameethanol;methanamine
PubChem CID174381315
Molecular FormulaC5H21N3O
Molecular Weight139.24 g/mol
Exact Mass139.17
IUPAC Nameethanol;methanamine
SMILESCCO.CN.CN.CN
InChIInChI=1S/C2H6O.3CH5N/c1-2-3;3*1-2/h3H,2H2,1H3;3*2H2,1H3
InChIKeyYJUPMZFKYGLLLY-UHFFFAOYSA-N
XLogP-1.28
TPSA98.29 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 5-1.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 175198419
ethanol;methanamine;hydrate
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CID 11759588
CID 11759588
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ethanol;methanol
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ethanol;stibane
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ethanol;hydron
CID 174459614
ethanol;phosphane
CID 159788730
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CID 173204929
ethanol;propane
CID 158736248
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CID 150841781

Frequently Asked Questions

What is the IUPAC name of ethanol;methanamine?
The IUPAC name of ethanol;methanamine (CID 174381315) is ethanol;methanamine.
What is the SMILES notation for ethanol;methanamine?
The canonical SMILES for ethanol;methanamine is CCO.CN.CN.CN.
What is the InChIKey of ethanol;methanamine?
The InChIKey is YJUPMZFKYGLLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O.3CH5N/c1-2-3;3*1-2/h3H,2H2,1H3;3*2H2,1H3.
What are the key properties of ethanol;methanamine?
ethanol;methanamine has a molecular weight of 139.24 g/mol, XLogP of -1.28, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;methanamine is sourced from PubChem (CID 174381315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).