1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide

C13H24N2O2 — CID 119137408

IUPAC1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide
SMILESCC(C)(C)CCC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C13H24N2O2/c1-13(2,3)7-4-11(16)15-8-5-10(6-9-15)12(14)17/h10H,4-9H2,1-3H3,(H2,14,17)
InChIKeyOAJGVYICNRXEDW-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.54
Rot. Bonds3

About 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide

1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide (PubChem CID 119137408) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide
PubChem CID119137408
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide
SMILESCC(C)(C)CCC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C13H24N2O2/c1-13(2,3)7-4-11(16)15-8-5-10(6-9-15)12(14)17/h10H,4-9H2,1-3H3,(H2,14,17)
InChIKeyOAJGVYICNRXEDW-UHFFFAOYSA-N
XLogP1.54
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,4-dimethyl-1-(4-methylpiperidin-1-yl)pentan-1-one
CID 70915057
1-(3-cyclohexylpropanoyl)piperidine-4-carboxamide
CID 17312024
1-(3-amino-3-methylbutanoyl)piperidine-4-carboxamide
CID 64683539
4-(4-carbamoylpiperidin-1-yl)-4-oxobutanoic acid
CID 2826389
1-(4-cyclohexylbutanoyl)piperidine-4-carboxamide
CID 78784857
1-(3,3-dimethylbutyl)piperidine-4-carboxamide
CID 20792956
2-[1-(4,4-dimethylpentanoyl)piperidin-4-yl]acetic acid
CID 119178332
1-(5-hydroxypentanoyl)piperidine-4-carboxamide
CID 79199439
1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide
CID 82683543
4-(4-carbamoylpiperidin-1-yl)-2,2-diethyl-4-oxobutanoic acid
CID 43437467
1-(3-aminopiperidin-1-yl)-4,4-dimethylpentan-1-one
CID 115277222
1-[4-(2-chloroethoxy)piperidin-1-yl]-4,4-dimethylpentan-1-one
CID 114212917

Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide (CID 119137408) is 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide is CC(C)(C)CCC(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide?
The InChIKey is OAJGVYICNRXEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(2,3)7-4-11(16)15-8-5-10(6-9-15)12(14)17/h10H,4-9H2,1-3H3,(H2,14,17).
What are the key properties of 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide?
1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 119137408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).