methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate

C11H17NO3 — CID 79833593

IUPACmethyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1C(=O)C1CC1
InChIInChI=1S/C11H17NO3/c1-15-11(14)9-4-2-3-7-12(9)10(13)8-5-6-8/h8-9H,2-7H2,1H3/t9-/m1/s1
InChIKeyBNUNRKRXUYEHBS-SECBINFHSA-N
MW211.26 g/mol
LogP0.95
Rot. Bonds2

About methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate

methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate (PubChem CID 79833593) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate.

Molecular Properties

Compound Namemethyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate
PubChem CID79833593
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Namemethyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1C(=O)C1CC1
InChIInChI=1S/C11H17NO3/c1-15-11(14)9-4-2-3-7-12(9)10(13)8-5-6-8/h8-9H,2-7H2,1H3/t9-/m1/s1
InChIKeyBNUNRKRXUYEHBS-SECBINFHSA-N
XLogP0.95
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2R)-1-(cyclopentanecarbonyl)piperidine-2-carboxylate
CID 79833170
methyl 1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate
CID 43623815
methyl 1-(4-hydroxycyclohexanecarbonyl)pyrrolidine-2-carboxylate
CID 112531508
methyl 1-(1,1-dioxothiolane-3-carbonyl)pyrrolidine-2-carboxylate
CID 43410317
methyl (2S)-1-(azetidine-3-carbonyl)pyrrolidine-2-carboxylate
CID 174918587
methyl 1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidine-2-carboxylate
CID 79165530
methyl 1-(2,2-difluoroacetyl)piperidine-2-carboxylate
CID 103514360
methyl (2R)-1-aminopiperidine-2-carboxylate
CID 90433668
methyl (2R)-1-(3-methyloxolane-2-carbonyl)piperidine-2-carboxylate
CID 81463255
methyl (2R)-1-(2-cyclobutylacetyl)piperidine-2-carboxylate
CID 103737516
methyl (2R)-1-(2,3-dimethylbutanoyl)piperidine-2-carboxylate
CID 79833510
methyl 1-(2,2-dicyclopropylacetyl)piperidine-2-carboxylate
CID 112745083

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate?
The IUPAC name of methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate (CID 79833593) is methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate.
What is the SMILES notation for methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate?
The canonical SMILES for methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate is COC(=O)[C@H]1CCCCN1C(=O)C1CC1.
What is the InChIKey of methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate?
The InChIKey is BNUNRKRXUYEHBS-SECBINFHSA-N. The full InChI is InChI=1S/C11H17NO3/c1-15-11(14)9-4-2-3-7-12(9)10(13)8-5-6-8/h8-9H,2-7H2,1H3/t9-/m1/s1.
What are the key properties of methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate?
methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate has a molecular weight of 211.26 g/mol, XLogP of 0.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate is sourced from PubChem (CID 79833593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).