1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide

C15H28N2O2 — CID 156820275

IUPAC1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide
SMILESCC(C)CNC(=O)C1CCN(CC(=O)C(C)C)CC1
InChIInChI=1S/C15H28N2O2/c1-11(2)9-16-15(19)13-5-7-17(8-6-13)10-14(18)12(3)4/h11-13H,5-10H2,1-4H3,(H,16,19)
InChIKeyTZDZWDYEAURZES-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds6

About 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide

1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide (PubChem CID 156820275) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide
PubChem CID156820275
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide
SMILESCC(C)CNC(=O)C1CCN(CC(=O)C(C)C)CC1
InChIInChI=1S/C15H28N2O2/c1-11(2)9-16-15(19)13-5-7-17(8-6-13)10-14(18)12(3)4/h11-13H,5-10H2,1-4H3,(H,16,19)
InChIKeyTZDZWDYEAURZES-UHFFFAOYSA-N
XLogP1.70
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide (CID 156820275) is 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide is CC(C)CNC(=O)C1CCN(CC(=O)C(C)C)CC1.
What is the InChIKey of 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide?
The InChIKey is TZDZWDYEAURZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-11(2)9-16-15(19)13-5-7-17(8-6-13)10-14(18)12(3)4/h11-13H,5-10H2,1-4H3,(H,16,19).
What are the key properties of 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide?
1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-oxobutyl)-N-(2-methylpropyl)piperidine-4-carboxamide is sourced from PubChem (CID 156820275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).