2-[cyclopentyl(methoxycarbonyl)amino]acetic acid

C9H15NO4 — CID 60829078

IUPAC2-[cyclopentyl(methoxycarbonyl)amino]acetic acid
SMILESCOC(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C9H15NO4/c1-14-9(13)10(6-8(11)12)7-4-2-3-5-7/h7H,2-6H2,1H3,(H,11,12)
InChIKeyOKJGSXNDZPXQBF-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.08
Rot. Bonds3

About 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid

2-[cyclopentyl(methoxycarbonyl)amino]acetic acid (PubChem CID 60829078) has the molecular formula C9H15NO4 and a molecular weight of 201.22 g/mol. Its IUPAC name is 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(methoxycarbonyl)amino]acetic acid
PubChem CID60829078
Molecular FormulaC9H15NO4
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name2-[cyclopentyl(methoxycarbonyl)amino]acetic acid
SMILESCOC(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C9H15NO4/c1-14-9(13)10(6-8(11)12)7-4-2-3-5-7/h7H,2-6H2,1H3,(H,11,12)
InChIKeyOKJGSXNDZPXQBF-UHFFFAOYSA-N
XLogP1.08
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid (CID 60829078) is 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid is COC(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid?
The InChIKey is OKJGSXNDZPXQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO4/c1-14-9(13)10(6-8(11)12)7-4-2-3-5-7/h7H,2-6H2,1H3,(H,11,12).
What are the key properties of 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid?
2-[cyclopentyl(methoxycarbonyl)amino]acetic acid has a molecular weight of 201.22 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methoxycarbonyl)amino]acetic acid is sourced from PubChem (CID 60829078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).