ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate

C15H26N2O3 — CID 114423535

IUPACethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
SMILESCCOC(=O)C1CCCCN1C(=O)C1CC(C)CCN1
InChIInChI=1S/C15H26N2O3/c1-3-20-15(19)13-6-4-5-9-17(13)14(18)12-10-11(2)7-8-16-12/h11-13,16H,3-10H2,1-2H3
InChIKeyLSARRCKJWKDFEM-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.32
Rot. Bonds3

About ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate

ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate (PubChem CID 114423535) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate.

Molecular Properties

Compound Nameethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
PubChem CID114423535
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Nameethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
SMILESCCOC(=O)C1CCCCN1C(=O)C1CC(C)CCN1
InChIInChI=1S/C15H26N2O3/c1-3-20-15(19)13-6-4-5-9-17(13)14(18)12-10-11(2)7-8-16-12/h11-13,16H,3-10H2,1-2H3
InChIKeyLSARRCKJWKDFEM-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
CID 114423341
ethyl 4-(4-methylpiperidine-2-carbonyl)thiomorpholine-3-carboxylate
CID 114423337
(2R)-1-(4-methylpiperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 103869598
methyl 1-(4-ethylpiperidine-2-carbonyl)piperidine-2-carboxylate
CID 114428408
ethyl 1-[(3R)-piperidine-3-carbonyl]piperidine-2-carboxylate
CID 81128745
ethyl 1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxylate
CID 55005582
2-(2-ethoxycarbonylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103978462
ethyl 1-(cyclopent-3-ene-1-carbonyl)piperidine-2-carboxylate
CID 79002856
ethyl 1-(2-aminocyclohexanecarbonyl)piperidine-2-carboxylate
CID 64824198
ethyl 1-(tricyclo[3.2.1.02,4]octane-3-carbonyl)pyrrolidine-2-carboxylate
CID 103913398
ethyl 1-(pyrrolidine-1-carbonyl)piperidine-2-carboxylate
CID 113331358
ethyl 4-[(2R)-piperidine-2-carbonyl]thiomorpholine-3-carboxylate
CID 104913277

Frequently Asked Questions

What is the IUPAC name of ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The IUPAC name of ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate (CID 114423535) is ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate.
What is the SMILES notation for ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The canonical SMILES for ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate is CCOC(=O)C1CCCCN1C(=O)C1CC(C)CCN1.
What is the InChIKey of ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The InChIKey is LSARRCKJWKDFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-20-15(19)13-6-4-5-9-17(13)14(18)12-10-11(2)7-8-16-12/h11-13,16H,3-10H2,1-2H3.
What are the key properties of ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate has a molecular weight of 282.38 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate is sourced from PubChem (CID 114423535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).