2-aminoacetaldehyde;ethane;propan-1-amine

C7H20N2O — CID 142274346

IUPAC2-aminoacetaldehyde;ethane;propan-1-amine
SMILESCC.CCCN.NCC=O
InChIInChI=1S/C3H9N.C2H5NO.C2H6/c1-2-3-4;3-1-2-4;1-2/h2-4H2,1H3;2H,1,3H2;1-2H3
InChIKeySDCTZYHZOOHJBH-UHFFFAOYSA-N
MW148.25 g/mol
LogP0.53
Rot. Bonds2

About 2-aminoacetaldehyde;ethane;propan-1-amine

2-aminoacetaldehyde;ethane;propan-1-amine (PubChem CID 142274346) has the molecular formula C7H20N2O and a molecular weight of 148.25 g/mol. Its IUPAC name is 2-aminoacetaldehyde;ethane;propan-1-amine.

Molecular Properties

Compound Name2-aminoacetaldehyde;ethane;propan-1-amine
PubChem CID142274346
Molecular FormulaC7H20N2O
Molecular Weight148.25 g/mol
Exact Mass148.16
IUPAC Name2-aminoacetaldehyde;ethane;propan-1-amine
SMILESCC.CCCN.NCC=O
InChIInChI=1S/C3H9N.C2H5NO.C2H6/c1-2-3-4;3-1-2-4;1-2/h2-4H2,1H3;2H,1,3H2;1-2H3
InChIKeySDCTZYHZOOHJBH-UHFFFAOYSA-N
XLogP0.53
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-aminoacetaldehyde;ethane;propan-1-amine?
The IUPAC name of 2-aminoacetaldehyde;ethane;propan-1-amine (CID 142274346) is 2-aminoacetaldehyde;ethane;propan-1-amine.
What is the SMILES notation for 2-aminoacetaldehyde;ethane;propan-1-amine?
The canonical SMILES for 2-aminoacetaldehyde;ethane;propan-1-amine is CC.CCCN.NCC=O.
What is the InChIKey of 2-aminoacetaldehyde;ethane;propan-1-amine?
The InChIKey is SDCTZYHZOOHJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.C2H5NO.C2H6/c1-2-3-4;3-1-2-4;1-2/h2-4H2,1H3;2H,1,3H2;1-2H3.
What are the key properties of 2-aminoacetaldehyde;ethane;propan-1-amine?
2-aminoacetaldehyde;ethane;propan-1-amine has a molecular weight of 148.25 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetaldehyde;ethane;propan-1-amine is sourced from PubChem (CID 142274346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).