4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid

C15H29N3O2 — CID 140504466

IUPAC4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid
SMILESCN1CCC(N2CCN(C(=O)O)CC2)C(C)(C)C1(C)C
InChIInChI=1S/C15H29N3O2/c1-14(2)12(6-7-16(5)15(14,3)4)17-8-10-18(11-9-17)13(19)20/h12H,6-11H2,1-5H3,(H,19,20)
InChIKeyFECHKWKZGCQHLH-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.79
Rot. Bonds1

About 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid

4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid (PubChem CID 140504466) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid.

Molecular Properties

Compound Name4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid
PubChem CID140504466
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid
SMILESCN1CCC(N2CCN(C(=O)O)CC2)C(C)(C)C1(C)C
InChIInChI=1S/C15H29N3O2/c1-14(2)12(6-7-16(5)15(14,3)4)17-8-10-18(11-9-17)13(19)20/h12H,6-11H2,1-5H3,(H,19,20)
InChIKeyFECHKWKZGCQHLH-UHFFFAOYSA-N
XLogP1.79
TPSA47.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic 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

2-Tert-butyl-4-[4-(2-fluoroethyl)piperazin-1-yl]piperidine-1-carboxylic acid
CID 86644807
4-(2-Tert-butyl-4-fluoropiperidin-1-yl)piperidine-1-carboxylic acid
CID 161292228
4-(5-Azaspiro[2.5]octan-5-yl)-3-fluoropiperidine-1-carboxylic acid
CID 172761468
2,2-Ditert-butylpiperazine-1,4-dicarboxylic acid
CID 53433188
(2S)-2-tert-butyl-4-methyl-2-propan-2-ylpiperazine-1-carboxylic acid
CID 66936266
4-(1,2,2,6,6-Pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid
CID 67216941
2-[4-Butyl-4-(dimethylamino)piperidin-1-yl]ethyl-methylcarbamic acid
CID 67367572
2-Tert-butyl-4-(piperidin-1-ylmethyl)piperidine-1-carboxylic acid
CID 67537691
2,2,3,3-Tetramethylpiperidine-1-carboxylic acid
CID 68297915
2-Tert-butyl-4-(4-methylpiperidin-1-yl)piperidine-1-carboxylic acid
CID 68668122
4-(1-Tert-butylpiperidin-4-yl)piperidine-1-carboxylic acid
CID 68668509
4-(1-Tert-butylpiperidin-4-yl)piperazine-1-carboxylic acid
CID 69056445

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid?
The IUPAC name of 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid (CID 140504466) is 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid.
What is the SMILES notation for 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid?
The canonical SMILES for 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid is CN1CCC(N2CCN(C(=O)O)CC2)C(C)(C)C1(C)C.
What is the InChIKey of 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid?
The InChIKey is FECHKWKZGCQHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-14(2)12(6-7-16(5)15(14,3)4)17-8-10-18(11-9-17)13(19)20/h12H,6-11H2,1-5H3,(H,19,20).
What are the key properties of 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid?
4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid has a molecular weight of 283.42 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,2,3,3-pentamethylpiperidin-4-yl)piperazine-1-carboxylic acid is sourced from PubChem (CID 140504466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).