N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride

C9H19ClN2O — CID 118998343

IUPACN-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)N(C)CC1CCNCC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-8(12)11(2)7-9-3-5-10-6-4-9;/h9-10H,3-7H2,1-2H3;1H
InChIKeyDMSXTZIYRUAFDL-UHFFFAOYSA-N
MW206.72 g/mol
LogP0.89
Rot. Bonds2

About N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride

N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride (PubChem CID 118998343) has the molecular formula C9H19ClN2O and a molecular weight of 206.72 g/mol. Its IUPAC name is N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
PubChem CID118998343
Molecular FormulaC9H19ClN2O
Molecular Weight206.72 g/mol
Exact Mass206.12
IUPAC NameN-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)N(C)CC1CCNCC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-8(12)11(2)7-9-3-5-10-6-4-9;/h9-10H,3-7H2,1-2H3;1H
InChIKeyDMSXTZIYRUAFDL-UHFFFAOYSA-N
XLogP0.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.72
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride
CID 129319655
2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide
CID 103514236
2,2-dicyclopropyl-N-methyl-N-(piperidin-4-ylmethyl)acetamide
CID 112745071
N-methyl-N-(piperidin-4-ylmethyl)but-2-enamide
CID 79720456
N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide
CID 69300106
N,N-dimethyl-1-piperidin-4-ylmethanamine;dihydrochloride
CID 23153381
N-[(4-acetylcyclohexyl)methyl]-N-methylacetamide
CID 143959726
2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720600
N-(cyclobutylmethyl)-N-methyl-3-piperidin-4-ylpropanamide
CID 62860278
N-methyl-N-(piperidin-4-ylmethyl)adamantane-2-carboxamide
CID 81098696
4-tert-butyl-N-methyl-N-(piperidin-4-ylmethyl)cyclohexane-1-carboxamide
CID 79700426
N,2,4,5-tetramethyl-N-(piperidin-4-ylmethyl)oxolane-3-carboxamide
CID 79720744

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride?
The IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride (CID 118998343) is N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride?
The canonical SMILES for N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride is CC(=O)N(C)CC1CCNCC1.Cl.
What is the InChIKey of N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride?
The InChIKey is DMSXTZIYRUAFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.ClH/c1-8(12)11(2)7-9-3-5-10-6-4-9;/h9-10H,3-7H2,1-2H3;1H.
What are the key properties of N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride?
N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride has a molecular weight of 206.72 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride is sourced from PubChem (CID 118998343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).