3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride

C11H23ClN2O — CID 53255531

IUPAC3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(C)(C)CC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C11H22N2O.ClH/c1-11(2,3)8-10(14)13-9-4-6-12-7-5-9;/h9,12H,4-8H2,1-3H3,(H,13,14);1H
InChIKeyWSQAVQZODJTELW-UHFFFAOYSA-N
MW234.77 g/mol
LogP1.71
Rot. Bonds2

About 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride

3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 53255531) has the molecular formula C11H23ClN2O and a molecular weight of 234.77 g/mol. Its IUPAC name is 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound Name3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride
PubChem CID53255531
Molecular FormulaC11H23ClN2O
Molecular Weight234.77 g/mol
Exact Mass234.15
IUPAC Name3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(C)(C)CC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C11H22N2O.ClH/c1-11(2,3)8-10(14)13-9-4-6-12-7-5-9;/h9,12H,4-8H2,1-3H3,(H,13,14);1H
InChIKeyWSQAVQZODJTELW-UHFFFAOYSA-N
XLogP1.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.77
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(3,3-dimethylbutanoylamino)cyclobutyl]-3,3-dimethylbutanamide
CID 159337962
N-(8-azabicyclo[3.2.1]octan-3-yl)-3,3-dimethylbutanamide;hydrochloride
CID 119455659
N,N'-dicyclopropyl-3,3-dimethylpentanediamide
CID 59002749
N-piperidin-4-ylhexanamide;hydrochloride
CID 47002713
tert-butyl N-[4-(3,3-dimethylbutanoylamino)cyclohexyl]carbamate
CID 86277406
2-chloro-5-(3,3-dimethylbutanoylamino)-N-piperidin-4-ylbenzamide;hydrochloride
CID 119390511
N-cyclopent-3-en-1-yl-3,3-dimethylbutanamide
CID 130669858
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 110819893
N-cyclopropyl-2-(piperidin-4-ylamino)acetamide
CID 61016595
N-(1,4-dioxaspiro[4.5]decan-8-yl)-3,3-dimethylbutanamide
CID 112729599
ethyl 4-(3,3-dimethylbutanoylamino)piperidine-1-carboxylate
CID 110756025
2-(diethylsulfamoyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119390469

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride (CID 53255531) is 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride is CC(C)(C)CC(=O)NC1CCNCC1.Cl.
What is the InChIKey of 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is WSQAVQZODJTELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O.ClH/c1-11(2,3)8-10(14)13-9-4-6-12-7-5-9;/h9,12H,4-8H2,1-3H3,(H,13,14);1H.
What are the key properties of 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride?
3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 234.77 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 53255531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).