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

C14H24N2O3 — CID 114423341

IUPACmethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
SMILESCOC(=O)C1CCCCN1C(=O)C1CC(C)CCN1
InChIInChI=1S/C14H24N2O3/c1-10-6-7-15-11(9-10)13(17)16-8-4-3-5-12(16)14(18)19-2/h10-12,15H,3-9H2,1-2H3
InChIKeyBGYVWIBPHRFPGF-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.93
Rot. Bonds2

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

methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate (PubChem CID 114423341) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate.

Molecular Properties

Compound Namemethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
PubChem CID114423341
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Namemethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
SMILESCOC(=O)C1CCCCN1C(=O)C1CC(C)CCN1
InChIInChI=1S/C14H24N2O3/c1-10-6-7-15-11(9-10)13(17)16-8-4-3-5-12(16)14(18)19-2/h10-12,15H,3-9H2,1-2H3
InChIKeyBGYVWIBPHRFPGF-UHFFFAOYSA-N
XLogP0.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate
CID 114423535
methyl 1-(4-ethylpiperidine-2-carbonyl)piperidine-2-carboxylate
CID 114428408
(2R)-1-(4-methylpiperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 103869598
methyl 1-(1,3-thiazolidine-4-carbonyl)pyrrolidine-2-carboxylate
CID 60939361
methyl (2R)-1-(cyclopentanecarbonyl)piperidine-2-carboxylate
CID 79833170
methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate
CID 79833593
methyl (2S)-1-(azetidine-3-carbonyl)pyrrolidine-2-carboxylate
CID 174918587
methyl 1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate
CID 43623815
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(4-methylpiperidin-2-yl)methanone
CID 114424404
2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl-(4-methylpiperidin-2-yl)methanone
CID 114423452
methyl 1-(4-hydroxycyclohexanecarbonyl)pyrrolidine-2-carboxylate
CID 112531508
methyl 1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidine-2-carboxylate
CID 79165530

Frequently Asked Questions

What is the IUPAC name of methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The IUPAC name of methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate (CID 114423341) is methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate.
What is the SMILES notation for methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The canonical SMILES for methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate is COC(=O)C1CCCCN1C(=O)C1CC(C)CCN1.
What is the InChIKey of methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
The InChIKey is BGYVWIBPHRFPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-10-6-7-15-11(9-10)13(17)16-8-4-3-5-12(16)14(18)19-2/h10-12,15H,3-9H2,1-2H3.
What are the key properties of methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate?
methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate has a molecular weight of 268.36 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(4-methylpiperidine-2-carbonyl)piperidine-2-carboxylate is sourced from PubChem (CID 114423341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).