N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride

C12H25ClN2O — CID 21144811

IUPACN-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride
SMILESCC1CCCC(C)N1NC(=O)C(C)(C)C.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-9-7-6-8-10(2)14(9)13-11(15)12(3,4)5;/h9-10H,6-8H2,1-5H3,(H,13,15);1H
InChIKeyYKDMAKBWGRNDHS-UHFFFAOYSA-N
MW248.80 g/mol
LogP2.75
Rot. Bonds1

About N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride

N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride (PubChem CID 21144811) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride
PubChem CID21144811
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC NameN-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride
SMILESCC1CCCC(C)N1NC(=O)C(C)(C)C.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-9-7-6-8-10(2)14(9)13-11(15)12(3,4)5;/h9-10H,6-8H2,1-5H3,(H,13,15);1H
InChIKeyYKDMAKBWGRNDHS-UHFFFAOYSA-N
XLogP2.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride?
The IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride (CID 21144811) is N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride.
What is the SMILES notation for N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride?
The canonical SMILES for N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride is CC1CCCC(C)N1NC(=O)C(C)(C)C.Cl.
What is the InChIKey of N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride?
The InChIKey is YKDMAKBWGRNDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-9-7-6-8-10(2)14(9)13-11(15)12(3,4)5;/h9-10H,6-8H2,1-5H3,(H,13,15);1H.
What are the key properties of N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride?
N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanamide;hydrochloride is sourced from PubChem (CID 21144811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).