N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide

C13H27N3O — CID 63693325

IUPACN-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide
SMILESCN(C)CCCN(C)C(=O)CC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-15(2)9-4-10-16(3)13(17)11-12-5-7-14-8-6-12/h12,14H,4-11H2,1-3H3
InChIKeyHAUOKJUDWNHBDL-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.79
Rot. Bonds6

About N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide

N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide (PubChem CID 63693325) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide
PubChem CID63693325
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide
SMILESCN(C)CCCN(C)C(=O)CC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-15(2)9-4-10-16(3)13(17)11-12-5-7-14-8-6-12/h12,14H,4-11H2,1-3H3
InChIKeyHAUOKJUDWNHBDL-UHFFFAOYSA-N
XLogP0.79
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-methyl-2-piperidin-4-ylacetamide
CID 24710322
N-(2-ethoxyethyl)-N-methyl-2-piperidin-4-ylacetamide
CID 81058333
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[3-(dimethylamino)propyl]-N-methylacetamide
CID 79615612
N-methyl-N-(4-methylpentyl)-2-pyrrolidin-3-ylacetamide
CID 115160396
N-methyl-3-[methyl-(2-piperidin-4-ylacetyl)amino]propanamide;hydrochloride
CID 119772573
N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
N-(2-cyclopentylethyl)-N-methyl-2-pyrrolidin-3-ylacetamide
CID 115160413
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-piperidin-4-ylacetamide
CID 64518653
N-methyl-2-piperidin-4-yl-N-propan-2-ylacetamide
CID 24690049
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-2-piperidin-4-ylacetamide
CID 114948933
N-(3-aminopropyl)-2-cycloheptyl-N-methylacetamide
CID 115737510
2-[4-(aminomethyl)cyclohexyl]-N-[2-(dimethylamino)ethyl]-N-methylacetamide
CID 63725529

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide (CID 63693325) is N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide is CN(C)CCCN(C)C(=O)CC1CCNCC1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide?
The InChIKey is HAUOKJUDWNHBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-15(2)9-4-10-16(3)13(17)11-12-5-7-14-8-6-12/h12,14H,4-11H2,1-3H3.
What are the key properties of N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide?
N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide has a molecular weight of 241.38 g/mol, XLogP of 0.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide is sourced from PubChem (CID 63693325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).