2-(2-aminoimidazolidin-1-yl)acetic acid

C5H11N3O2 — CID 21198653

IUPAC2-(2-aminoimidazolidin-1-yl)acetic acid
SMILESNC1NCCN1CC(=O)O
InChIInChI=1S/C5H11N3O2/c6-5-7-1-2-8(5)3-4(9)10/h5,7H,1-3,6H2,(H,9,10)
InChIKeyWYLINONBAMFOQC-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.78
Rot. Bonds2

About 2-(2-aminoimidazolidin-1-yl)acetic acid

2-(2-aminoimidazolidin-1-yl)acetic acid (PubChem CID 21198653) has the molecular formula C5H11N3O2 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-(2-aminoimidazolidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(2-aminoimidazolidin-1-yl)acetic acid
PubChem CID21198653
Molecular FormulaC5H11N3O2
Molecular Weight145.16 g/mol
Exact Mass145.09
IUPAC Name2-(2-aminoimidazolidin-1-yl)acetic acid
SMILESNC1NCCN1CC(=O)O
InChIInChI=1S/C5H11N3O2/c6-5-7-1-2-8(5)3-4(9)10/h5,7H,1-3,6H2,(H,9,10)
InChIKeyWYLINONBAMFOQC-UHFFFAOYSA-N
XLogP-1.78
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoimidazolidin-1-yl)acetic acid?
The IUPAC name of 2-(2-aminoimidazolidin-1-yl)acetic acid (CID 21198653) is 2-(2-aminoimidazolidin-1-yl)acetic acid.
What is the SMILES notation for 2-(2-aminoimidazolidin-1-yl)acetic acid?
The canonical SMILES for 2-(2-aminoimidazolidin-1-yl)acetic acid is NC1NCCN1CC(=O)O.
What is the InChIKey of 2-(2-aminoimidazolidin-1-yl)acetic acid?
The InChIKey is WYLINONBAMFOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2/c6-5-7-1-2-8(5)3-4(9)10/h5,7H,1-3,6H2,(H,9,10).
What are the key properties of 2-(2-aminoimidazolidin-1-yl)acetic acid?
2-(2-aminoimidazolidin-1-yl)acetic acid has a molecular weight of 145.16 g/mol, XLogP of -1.78, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoimidazolidin-1-yl)acetic acid is sourced from PubChem (CID 21198653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).