2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid

C5H10N2O2 — CID 129171383

IUPAC2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid
SMILESC/C(=C\N)NCC(=O)O
InChIInChI=1S/C5H10N2O2/c1-4(2-6)7-3-5(8)9/h2,7H,3,6H2,1H3,(H,8,9)/b4-2+
InChIKeyWBHVTDZFOHZMTK-DUXPYHPUSA-N
MW130.15 g/mol
LogP-0.52
Rot. Bonds3

About 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid

2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid (PubChem CID 129171383) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid.

Molecular Properties

Compound Name2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid
PubChem CID129171383
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid
SMILESC/C(=C\N)NCC(=O)O
InChIInChI=1S/C5H10N2O2/c1-4(2-6)7-3-5(8)9/h2,7H,3,6H2,1H3,(H,8,9)/b4-2+
InChIKeyWBHVTDZFOHZMTK-DUXPYHPUSA-N
XLogP-0.52
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid?
The IUPAC name of 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid (CID 129171383) is 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid.
What is the SMILES notation for 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid?
The canonical SMILES for 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid is C/C(=C\N)NCC(=O)O.
What is the InChIKey of 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid?
The InChIKey is WBHVTDZFOHZMTK-DUXPYHPUSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-4(2-6)7-3-5(8)9/h2,7H,3,6H2,1H3,(H,8,9)/b4-2+.
What are the key properties of 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid?
2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid has a molecular weight of 130.15 g/mol, XLogP of -0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(E)-1-aminoprop-1-en-2-yl]amino]acetic acid is sourced from PubChem (CID 129171383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).