cyclopentylmethyl (2S)-2-aminopentanoate

C11H21NO2 — CID 107565785

IUPACcyclopentylmethyl (2S)-2-aminopentanoate
SMILESCCC[C@H](N)C(=O)OCC1CCCC1
InChIInChI=1S/C11H21NO2/c1-2-5-10(12)11(13)14-8-9-6-3-4-7-9/h9-10H,2-8,12H2,1H3/t10-/m0/s1
InChIKeyQYBSUDJKIQHGJJ-JTQLQIEISA-N
MW199.29 g/mol
LogP1.85
Rot. Bonds5

About cyclopentylmethyl (2S)-2-aminopentanoate

cyclopentylmethyl (2S)-2-aminopentanoate (PubChem CID 107565785) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is cyclopentylmethyl (2S)-2-aminopentanoate.

Molecular Properties

Compound Namecyclopentylmethyl (2S)-2-aminopentanoate
PubChem CID107565785
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Namecyclopentylmethyl (2S)-2-aminopentanoate
SMILESCCC[C@H](N)C(=O)OCC1CCCC1
InChIInChI=1S/C11H21NO2/c1-2-5-10(12)11(13)14-8-9-6-3-4-7-9/h9-10H,2-8,12H2,1H3/t10-/m0/s1
InChIKeyQYBSUDJKIQHGJJ-JTQLQIEISA-N
XLogP1.85
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexylmethyl (2R)-2-aminopentanoate
CID 107565760
cyclopropylmethyl (2S)-2-aminopentanoate
CID 107565685
cyclopentylmethyl 2-aminobutanoate
CID 66322645
cyclopentylmethyl (2S)-2-amino-4-methylsulfanylbutanoate
CID 66322213
cyclopentyl 2-aminopentanoate
CID 61278203
cyclopropylmethyl 2-amino-4-hydroxybutanoate
CID 61243530
1-O-(cyclopentylmethyl) 3-O-ethyl 2-ethylpropanedioate
CID 174749024
bis(cyclopentylmethyl) 2-methylpropanedioate
CID 174545990
cyclopentylmethyl 2-methylpropanoate
CID 21063892
cyclopropylmethyl (2R)-2-amino-4-methylsulfanylbutanoate
CID 104909688
cyclopentylmethyl 4-(2-aminoethyl)heptanoate
CID 66323726
cyclopentylmethyl 2-amino-3,3-dimethylbutanoate
CID 66321580

Frequently Asked Questions

What is the IUPAC name of cyclopentylmethyl (2S)-2-aminopentanoate?
The IUPAC name of cyclopentylmethyl (2S)-2-aminopentanoate (CID 107565785) is cyclopentylmethyl (2S)-2-aminopentanoate.
What is the SMILES notation for cyclopentylmethyl (2S)-2-aminopentanoate?
The canonical SMILES for cyclopentylmethyl (2S)-2-aminopentanoate is CCC[C@H](N)C(=O)OCC1CCCC1.
What is the InChIKey of cyclopentylmethyl (2S)-2-aminopentanoate?
The InChIKey is QYBSUDJKIQHGJJ-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-5-10(12)11(13)14-8-9-6-3-4-7-9/h9-10H,2-8,12H2,1H3/t10-/m0/s1.
What are the key properties of cyclopentylmethyl (2S)-2-aminopentanoate?
cyclopentylmethyl (2S)-2-aminopentanoate has a molecular weight of 199.29 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl (2S)-2-aminopentanoate is sourced from PubChem (CID 107565785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).