4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid

C14H26N2O3 — CID 62332382

IUPAC4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid
SMILESCC1CCN(C(=O)NC(C)(C)CCC(=O)O)C(C)C1
InChIInChI=1S/C14H26N2O3/c1-10-6-8-16(11(2)9-10)13(19)15-14(3,4)7-5-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyXQOQRVMTFJGIFS-UHFFFAOYSA-N
MW270.37 g/mol
LogP2.46
Rot. Bonds4

About 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid

4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid (PubChem CID 62332382) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid.

Molecular Properties

Compound Name4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid
PubChem CID62332382
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid
SMILESCC1CCN(C(=O)NC(C)(C)CCC(=O)O)C(C)C1
InChIInChI=1S/C14H26N2O3/c1-10-6-8-16(11(2)9-10)13(19)15-14(3,4)7-5-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyXQOQRVMTFJGIFS-UHFFFAOYSA-N
XLogP2.46
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-oxobutanoic acid
CID 62331638
4-[[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]amino]-4-methylpentanoic acid
CID 104968032
6-[(2,4-dimethylpiperidine-1-carbonyl)amino]hexanoic acid
CID 62331104
(2S)-2-[(2,4-dimethylpiperidine-1-carbonyl)amino]pentanedioic acid
CID 62329876
4-[(2-ethyl-5-methylpyrrolidine-1-carbonyl)amino]-4-methylpentanoic acid
CID 83220540
4-[[2-(2-hydroxyethyl)piperidine-1-carbonyl]amino]-4-methylpentanoic acid
CID 62049062
3-[1-(2,4-dimethylpiperidine-1-carbonyl)piperidin-4-yl]propanoic acid
CID 62332210
4-methyl-4-[(4-propylpiperidine-1-carbonyl)amino]pentanoic acid
CID 62206502
3-[(2,4-dimethylpiperidine-1-carbonyl)-ethylamino]propanoic acid
CID 62331863
1-[(4-amino-2-methyl-4-oxobutan-2-yl)carbamoyl]-4-methylpiperidine-2-carboxylic acid
CID 106097897
2,4-dimethyl-N-propylpiperidine-1-carboxamide
CID 115644943
1-(tert-butylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
CID 106742306

Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid?
The IUPAC name of 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid (CID 62332382) is 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid.
What is the SMILES notation for 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid?
The canonical SMILES for 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid is CC1CCN(C(=O)NC(C)(C)CCC(=O)O)C(C)C1.
What is the InChIKey of 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid?
The InChIKey is XQOQRVMTFJGIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10-6-8-16(11(2)9-10)13(19)15-14(3,4)7-5-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18).
What are the key properties of 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid?
4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid has a molecular weight of 270.37 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid is sourced from PubChem (CID 62332382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).