methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate

C11H19NO3 — CID 79544161

IUPACmethyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate
SMILESCOC(=O)N1CCCC1C1CCCC1O
InChIInChI=1S/C11H19NO3/c1-15-11(14)12-7-3-5-9(12)8-4-2-6-10(8)13/h8-10,13H,2-7H2,1H3
InChIKeyVTHUMMLZESRVKQ-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.38
Rot. Bonds1

About methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate

methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate (PubChem CID 79544161) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate
PubChem CID79544161
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Namemethyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate
SMILESCOC(=O)N1CCCC1C1CCCC1O
InChIInChI=1S/C11H19NO3/c1-15-11(14)12-7-3-5-9(12)8-4-2-6-10(8)13/h8-10,13H,2-7H2,1H3
InChIKeyVTHUMMLZESRVKQ-UHFFFAOYSA-N
XLogP1.38
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylpropyl 2-(2-hydroxycyclohexyl)pyrrolidine-1-carboxylate
CID 79549343
1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one
CID 79545002
2-ethoxy-1-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]ethanone
CID 79544158
[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]-(2-methylcyclopentyl)methanone
CID 107180503
2-cyclopropyl-1-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]propan-1-one
CID 83148685
2-hydroxy-1-[(2R)-2-[(1S,2R)-2-hydroxycyclohexyl]pyrrolidin-1-yl]-2-methylpropan-1-one
CID 129449015
N-ethyl-2-(2-hydroxycyclopentyl)piperidine-1-carboxamide
CID 79545828
cyclohexyl-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
CID 79545603
1-[2-(2-hydroxycyclohexyl)piperidin-1-yl]butan-1-one
CID 79553643
1-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]-2-methyl-2-methylsulfonylpropan-1-one
CID 79544455
(3,5-dimethoxy-4-methylphenyl)-[(2R)-2-[(1S,2S)-2-hydroxycyclohexyl]pyrrolidin-1-yl]methanone
CID 129481027
1-[2-(2-hydroxycyclohexyl)pyrrolidin-1-yl]octan-1-one
CID 79539770

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate?
The IUPAC name of methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate (CID 79544161) is methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate.
What is the SMILES notation for methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate?
The canonical SMILES for methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate is COC(=O)N1CCCC1C1CCCC1O.
What is the InChIKey of methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate?
The InChIKey is VTHUMMLZESRVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-15-11(14)12-7-3-5-9(12)8-4-2-6-10(8)13/h8-10,13H,2-7H2,1H3.
What are the key properties of methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate?
methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate has a molecular weight of 213.28 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate is sourced from PubChem (CID 79544161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).