N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide

C16H32N2O — CID 23388585

IUPACN-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCCC(C)(C)C1(C(=O)NC(C)(C)C)CCN(C)CC1
InChIInChI=1S/C16H32N2O/c1-8-15(5,6)16(9-11-18(7)12-10-16)13(19)17-14(2,3)4/h8-12H2,1-7H3,(H,17,19)
InChIKeyGQMJLBAIUSLVPZ-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.05
Rot. Bonds3

About N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide

N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide (PubChem CID 23388585) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide
PubChem CID23388585
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCCC(C)(C)C1(C(=O)NC(C)(C)C)CCN(C)CC1
InChIInChI=1S/C16H32N2O/c1-8-15(5,6)16(9-11-18(7)12-10-16)13(19)17-14(2,3)4/h8-12H2,1-7H3,(H,17,19)
InChIKeyGQMJLBAIUSLVPZ-UHFFFAOYSA-N
XLogP3.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide (CID 23388585) is N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide is CCC(C)(C)C1(C(=O)NC(C)(C)C)CCN(C)CC1.
What is the InChIKey of N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The InChIKey is GQMJLBAIUSLVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-8-15(5,6)16(9-11-18(7)12-10-16)13(19)17-14(2,3)4/h8-12H2,1-7H3,(H,17,19).
What are the key properties of N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide?
N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide has a molecular weight of 268.44 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-methyl-4-(2-methylbutan-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 23388585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).