N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide

C12H24N2O — CID 70842274

IUPACN-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide
SMILESCC(=O)NCCCN1CC(C)CC(C)C1
InChIInChI=1S/C12H24N2O/c1-10-7-11(2)9-14(8-10)6-4-5-13-12(3)15/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyLFTBIFRZBBRZKY-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.49
Rot. Bonds4

About N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide

N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide (PubChem CID 70842274) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide.

Molecular Properties

Compound NameN-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide
PubChem CID70842274
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide
SMILESCC(=O)NCCCN1CC(C)CC(C)C1
InChIInChI=1S/C12H24N2O/c1-10-7-11(2)9-14(8-10)6-4-5-13-12(3)15/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyLFTBIFRZBBRZKY-UHFFFAOYSA-N
XLogP1.49
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide
CID 79993303
N-[2-[3-methyl-5-(methylamino)piperidin-1-yl]ethyl]acetamide
CID 83990134
1-[4-[(3S,5R)-3,5-dimethylpiperidin-1-yl]butyl]-2-methylguanidine
CID 124841464
7-amino-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]heptanamide;dihydrochloride
CID 119851231
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111331881
1-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-[[1-(hydroxymethyl)cyclopropyl]methyl]urea
CID 111618524
1-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111438194
1-amino-N-[4-(3,5-dimethylpiperidin-1-yl)butyl]cyclopentane-1-carboxamide
CID 119852759
N-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]acetamide
CID 126999485
oxan-4-yl N-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propyl]carbamate
CID 100763040
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-hydroxy-2-phenylacetamide
CID 111432382
2-[4-[(3S,5R)-3,5-dimethylpiperidin-1-yl]butylcarbamoylamino]propanediamide
CID 94050726

Frequently Asked Questions

What is the IUPAC name of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide?
The IUPAC name of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide (CID 70842274) is N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide.
What is the SMILES notation for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide?
The canonical SMILES for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide is CC(=O)NCCCN1CC(C)CC(C)C1.
What is the InChIKey of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide?
The InChIKey is LFTBIFRZBBRZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-7-11(2)9-14(8-10)6-4-5-13-12(3)15/h10-11H,4-9H2,1-3H3,(H,13,15).
What are the key properties of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide?
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide has a molecular weight of 212.34 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide is sourced from PubChem (CID 70842274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).