2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid

C13H22N2O4 — CID 66265046

IUPAC2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid
SMILESCNC1COCC1C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C13H22N2O4/c1-14-11-8-19-7-10(11)13(18)15(6-12(16)17)9-4-2-3-5-9/h9-11,14H,2-8H2,1H3,(H,16,17)
InChIKeyIWWUTGNPFRLXMB-UHFFFAOYSA-N
MW270.33 g/mol
LogP0.08
Rot. Bonds5

About 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid

2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid (PubChem CID 66265046) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid
PubChem CID66265046
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Name2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid
SMILESCNC1COCC1C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C13H22N2O4/c1-14-11-8-19-7-10(11)13(18)15(6-12(16)17)9-4-2-3-5-9/h9-11,14H,2-8H2,1H3,(H,16,17)
InChIKeyIWWUTGNPFRLXMB-UHFFFAOYSA-N
XLogP0.08
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid (CID 66265046) is 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid is CNC1COCC1C(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid?
The InChIKey is IWWUTGNPFRLXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c1-14-11-8-19-7-10(11)13(18)15(6-12(16)17)9-4-2-3-5-9/h9-11,14H,2-8H2,1H3,(H,16,17).
What are the key properties of 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid?
2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid has a molecular weight of 270.33 g/mol, XLogP of 0.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[4-(methylamino)oxolane-3-carbonyl]amino]acetic acid is sourced from PubChem (CID 66265046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).