4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid

C14H24N2O3 — CID 114424707

IUPAC4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid
SMILESCC1CCN(C(=O)C2(C)CCCCN2)C(C(=O)O)C1
InChIInChI=1S/C14H24N2O3/c1-10-5-8-16(11(9-10)12(17)18)13(19)14(2)6-3-4-7-15-14/h10-11,15H,3-9H2,1-2H3,(H,17,18)
InChIKeyZCZOCNDSMSSBFS-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.23
Rot. Bonds2

About 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid

4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid (PubChem CID 114424707) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid
PubChem CID114424707
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid
SMILESCC1CCN(C(=O)C2(C)CCCCN2)C(C(=O)O)C1
InChIInChI=1S/C14H24N2O3/c1-10-5-8-16(11(9-10)12(17)18)13(19)14(2)6-3-4-7-15-14/h10-11,15H,3-9H2,1-2H3,(H,17,18)
InChIKeyZCZOCNDSMSSBFS-UHFFFAOYSA-N
XLogP1.23
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(2-methylpyrrolidine-2-carbonyl)piperidine-2-carboxylic acid
CID 114424626
(2R,4R)-4-hydroxy-1-(2-methylpiperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 113430852
2-methyl-1-(2-methylpiperidine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 104596985
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(2-methylpiperidin-2-yl)methanone
CID 104597165
2-[1-(2-methylpiperidine-2-carbonyl)pyrrolidin-2-yl]acetic acid
CID 113430815
4-methyl-1-[(2R)-piperidine-2-carbonyl]piperidine-2-carboxylic acid
CID 104921848
[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(2-methylpiperidin-2-yl)methanone
CID 107217940
azetidin-1-yl-(2-methylpiperidin-2-yl)methanone
CID 126980517
4-methyl-1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylic acid
CID 115867385
2-cyclopropyl-3-(2-methylpiperidine-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 104596836
(3-hydroxyazetidin-1-yl)-(2-methylpiperidin-2-yl)methanone
CID 107217478
1-(3-aminopropylcarbamoyl)-4-methylpiperidine-2-carboxylic acid
CID 114425520

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid?
The IUPAC name of 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid (CID 114424707) is 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid.
What is the SMILES notation for 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid?
The canonical SMILES for 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid is CC1CCN(C(=O)C2(C)CCCCN2)C(C(=O)O)C1.
What is the InChIKey of 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid?
The InChIKey is ZCZOCNDSMSSBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-10-5-8-16(11(9-10)12(17)18)13(19)14(2)6-3-4-7-15-14/h10-11,15H,3-9H2,1-2H3,(H,17,18).
What are the key properties of 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid?
4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylpiperidine-2-carbonyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 114424707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).