methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate

C10H19NO2 — CID 81395951

IUPACmethyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate
SMILESCOC(=O)CN[C@@H](C)C1CCCC1
InChIInChI=1S/C10H19NO2/c1-8(9-5-3-4-6-9)11-7-10(12)13-2/h8-9,11H,3-7H2,1-2H3/t8-/m0/s1
InChIKeySYCISHOYFHRWJM-QMMMGPOBSA-N
MW185.27 g/mol
LogP1.33
Rot. Bonds4

About methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate

methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate (PubChem CID 81395951) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate
PubChem CID81395951
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Namemethyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate
SMILESCOC(=O)CN[C@@H](C)C1CCCC1
InChIInChI=1S/C10H19NO2/c1-8(9-5-3-4-6-9)11-7-10(12)13-2/h8-9,11H,3-7H2,1-2H3/t8-/m0/s1
InChIKeySYCISHOYFHRWJM-QMMMGPOBSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[[(1S)-1-cyclohexylethyl]amino]acetate
CID 81385124
tert-butyl 2-[[(1R)-1-cyclohexylethyl]amino]acetate
CID 81386235
methyl 2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetate
CID 43307422
tert-butyl 2-[[(1S)-1-cyclohexylethyl]amino]acetate
CID 81384159
methyl 4-(1-cyclopentylethylamino)butanoate
CID 62632824
2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81392535
2-[[(1S)-1-cyclopentylethyl]amino]-N-(1-methoxypropan-2-yl)acetamide
CID 81394863
2-[[(1S)-1-cycloheptylethyl]amino]-N-(2-methoxyethyl)acetamide
CID 81392388
2-[[(1R)-1-cyclohexylethyl]amino]-N-ethylacetamide
CID 81385685
N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393673
N-(cyanomethyl)-2-(1-cyclohexylethylamino)acetamide
CID 62407707
N-(cyanomethyl)-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393576

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate?
The IUPAC name of methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate (CID 81395951) is methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate.
What is the SMILES notation for methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate?
The canonical SMILES for methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate is COC(=O)CN[C@@H](C)C1CCCC1.
What is the InChIKey of methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate?
The InChIKey is SYCISHOYFHRWJM-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(9-5-3-4-6-9)11-7-10(12)13-2/h8-9,11H,3-7H2,1-2H3/t8-/m0/s1.
What are the key properties of methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate?
methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate has a molecular weight of 185.27 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[(1S)-1-cyclopentylethyl]amino]acetate is sourced from PubChem (CID 81395951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).