2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid

C10H18N2O3 — CID 78973399

IUPAC2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid
SMILESC[C@@H](N)C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C10H18N2O3/c1-7(11)10(15)12(6-9(13)14)8-4-2-3-5-8/h7-8H,2-6,11H2,1H3,(H,13,14)/t7-/m1/s1
InChIKeyMXLUWANJOYNLLV-SSDOTTSWSA-N
MW214.26 g/mol
LogP0.19
Rot. Bonds4

About 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid

2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid (PubChem CID 78973399) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid.

Molecular Properties

Compound Name2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid
PubChem CID78973399
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid
SMILESC[C@@H](N)C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C10H18N2O3/c1-7(11)10(15)12(6-9(13)14)8-4-2-3-5-8/h7-8H,2-6,11H2,1H3,(H,13,14)/t7-/m1/s1
InChIKeyMXLUWANJOYNLLV-SSDOTTSWSA-N
XLogP0.19
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
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-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid?
The IUPAC name of 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid (CID 78973399) is 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid.
What is the SMILES notation for 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid?
The canonical SMILES for 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid is C[C@@H](N)C(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid?
The InChIKey is MXLUWANJOYNLLV-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-7(11)10(15)12(6-9(13)14)8-4-2-3-5-8/h7-8H,2-6,11H2,1H3,(H,13,14)/t7-/m1/s1.
What are the key properties of 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid?
2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid has a molecular weight of 214.26 g/mol, XLogP of 0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-2-aminopropanoyl]-cyclopentylamino]acetic acid is sourced from PubChem (CID 78973399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).