2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid

C10H16N2O3 — CID 43465720

IUPAC2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid
SMILESCN(C(=O)CNCC(=O)O)C1=CCCC1
InChIInChI=1S/C10H16N2O3/c1-12(8-4-2-3-5-8)9(13)6-11-7-10(14)15/h4,11H,2-3,5-7H2,1H3,(H,14,15)
InChIKeyDQOVKGFBKXGPSP-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.19
Rot. Bonds5

About 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid

2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid (PubChem CID 43465720) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid
PubChem CID43465720
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid
SMILESCN(C(=O)CNCC(=O)O)C1=CCCC1
InChIInChI=1S/C10H16N2O3/c1-12(8-4-2-3-5-8)9(13)6-11-7-10(14)15/h4,11H,2-3,5-7H2,1H3,(H,14,15)
InChIKeyDQOVKGFBKXGPSP-UHFFFAOYSA-N
XLogP0.19
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid?
The IUPAC name of 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid (CID 43465720) is 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid?
The canonical SMILES for 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid is CN(C(=O)CNCC(=O)O)C1=CCCC1.
What is the InChIKey of 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid?
The InChIKey is DQOVKGFBKXGPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-12(8-4-2-3-5-8)9(13)6-11-7-10(14)15/h4,11H,2-3,5-7H2,1H3,(H,14,15).
What are the key properties of 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid?
2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid has a molecular weight of 212.25 g/mol, XLogP of 0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]amino]acetic acid is sourced from PubChem (CID 43465720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).