2-[carboxy(cyclopropyl)amino]acetic acid

C6H9NO4 — CID 19986922

IUPAC2-[carboxy(cyclopropyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)O)C1CC1
InChIInChI=1S/C6H9NO4/c8-5(9)3-7(6(10)11)4-1-2-4/h4H,1-3H2,(H,8,9)(H,10,11)
InChIKeyUHLRZHVODFDQHE-UHFFFAOYSA-N
MW159.14 g/mol
LogP0.21
Rot. Bonds3

About 2-[carboxy(cyclopropyl)amino]acetic acid

2-[carboxy(cyclopropyl)amino]acetic acid (PubChem CID 19986922) has the molecular formula C6H9NO4 and a molecular weight of 159.14 g/mol. Its IUPAC name is 2-[carboxy(cyclopropyl)amino]acetic acid.

Molecular Properties

Compound Name2-[carboxy(cyclopropyl)amino]acetic acid
PubChem CID19986922
Molecular FormulaC6H9NO4
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name2-[carboxy(cyclopropyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)O)C1CC1
InChIInChI=1S/C6H9NO4/c8-5(9)3-7(6(10)11)4-1-2-4/h4H,1-3H2,(H,8,9)(H,10,11)
InChIKeyUHLRZHVODFDQHE-UHFFFAOYSA-N
XLogP0.21
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[carboxy(cyclopropyl)amino]acetic acid?
The IUPAC name of 2-[carboxy(cyclopropyl)amino]acetic acid (CID 19986922) is 2-[carboxy(cyclopropyl)amino]acetic acid.
What is the SMILES notation for 2-[carboxy(cyclopropyl)amino]acetic acid?
The canonical SMILES for 2-[carboxy(cyclopropyl)amino]acetic acid is O=C(O)CN(C(=O)O)C1CC1.
What is the InChIKey of 2-[carboxy(cyclopropyl)amino]acetic acid?
The InChIKey is UHLRZHVODFDQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO4/c8-5(9)3-7(6(10)11)4-1-2-4/h4H,1-3H2,(H,8,9)(H,10,11).
What are the key properties of 2-[carboxy(cyclopropyl)amino]acetic acid?
2-[carboxy(cyclopropyl)amino]acetic acid has a molecular weight of 159.14 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[carboxy(cyclopropyl)amino]acetic acid is sourced from PubChem (CID 19986922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).