4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid

C14H24N2O3 — CID 63123499

IUPAC4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid
SMILESCC1CCCN(C(=O)N2CCC(C)(C(=O)O)CC2)C1
InChIInChI=1S/C14H24N2O3/c1-11-4-3-7-16(10-11)13(19)15-8-5-14(2,6-9-15)12(17)18/h11H,3-10H2,1-2H3,(H,17,18)
InChIKeyLNVUWIACBVGQMV-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.03
Rot. Bonds1

About 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid

4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid (PubChem CID 63123499) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid
PubChem CID63123499
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid
SMILESCC1CCCN(C(=O)N2CCC(C)(C(=O)O)CC2)C1
InChIInChI=1S/C14H24N2O3/c1-11-4-3-7-16(10-11)13(19)15-8-5-14(2,6-9-15)12(17)18/h11H,3-10H2,1-2H3,(H,17,18)
InChIKeyLNVUWIACBVGQMV-UHFFFAOYSA-N
XLogP2.03
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-aminopiperidine-1-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 63124373
4-methyl-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxylic acid
CID 55177179
1-(3-methylpiperidine-1-carbonyl)-4-propylpiperidine-4-carboxylic acid
CID 63126194
4-methyl-1-(2-methylmorpholine-4-carbonyl)piperidine-4-carboxylic acid
CID 55177373
1-(3-aminopyrrolidine-1-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 55176605
1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 63123868
1-[4-(3-methylpiperidine-1-carbonyl)piperazin-1-yl]ethanone
CID 108988685
azetidin-1-yl-(3-methylpyrrolidin-1-yl)methanone
CID 166738845
1-(4,4-dimethylazepane-1-carbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 65282949
1-(4-methylazepane-1-carbonyl)piperidine-3-carboxylic acid
CID 63627410
1-(3-methoxycarbonylpiperidine-1-carbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 115535303
1-(2-cyanomorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 79675798

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid?
The IUPAC name of 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid (CID 63123499) is 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid?
The canonical SMILES for 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid is CC1CCCN(C(=O)N2CCC(C)(C(=O)O)CC2)C1.
What is the InChIKey of 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid?
The InChIKey is LNVUWIACBVGQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-11-4-3-7-16(10-11)13(19)15-8-5-14(2,6-9-15)12(17)18/h11H,3-10H2,1-2H3,(H,17,18).
What are the key properties of 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid?
4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-methylpiperidine-1-carbonyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 63123499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).