2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride

C12H26ClN3O — CID 119913617

IUPAC2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride
SMILESCC(C)CNC(=O)CN(C)C1CCNCC1.Cl
InChIInChI=1S/C12H25N3O.ClH/c1-10(2)8-14-12(16)9-15(3)11-4-6-13-7-5-11;/h10-11,13H,4-9H2,1-3H3,(H,14,16);1H
InChIKeyZPHITHGPZJYAMF-UHFFFAOYSA-N
MW263.81 g/mol
LogP0.86
Rot. Bonds5

About 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride

2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride (PubChem CID 119913617) has the molecular formula C12H26ClN3O and a molecular weight of 263.81 g/mol. Its IUPAC name is 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride
PubChem CID119913617
Molecular FormulaC12H26ClN3O
Molecular Weight263.81 g/mol
Exact Mass263.18
IUPAC Name2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride
SMILESCC(C)CNC(=O)CN(C)C1CCNCC1.Cl
InChIInChI=1S/C12H25N3O.ClH/c1-10(2)8-14-12(16)9-15(3)11-4-6-13-7-5-11;/h10-11,13H,4-9H2,1-3H3,(H,14,16);1H
InChIKeyZPHITHGPZJYAMF-UHFFFAOYSA-N
XLogP0.86
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.81
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
CID 119913473
2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide
CID 125160379
N-(2-methylpropyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921772
2-[methyl(piperidin-4-yl)amino]-N,N-bis(2-methylpropyl)acetamide;hydrochloride
CID 119912437
N-(ethylcarbamoyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607364
2-[azepan-4-yl(methyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 104979554
2-[methyl(piperidin-4-yl)amino]-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide;dihydrochloride
CID 154909830
N-(cyclopropylcarbamoyl)-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
CID 119913095
N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
CID 119912445
2-[methyl-[2-[methyl(piperidin-4-yl)amino]acetyl]amino]-N-propylacetamide;hydrochloride
CID 119913381
N-[(1S)-1-(3,5-difluorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide
CID 99935705
N-(2-methylpropylcarbamoyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119932861

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride?
The IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride (CID 119913617) is 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride.
What is the SMILES notation for 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride?
The canonical SMILES for 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride is CC(C)CNC(=O)CN(C)C1CCNCC1.Cl.
What is the InChIKey of 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride?
The InChIKey is ZPHITHGPZJYAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O.ClH/c1-10(2)8-14-12(16)9-15(3)11-4-6-13-7-5-11;/h10-11,13H,4-9H2,1-3H3,(H,14,16);1H.
What are the key properties of 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride?
2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride has a molecular weight of 263.81 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride is sourced from PubChem (CID 119913617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).