N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide

C17H33N3O — CID 119841958

IUPACN-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
SMILESCCN1CCC(N(C)C(=O)CC(C)C2CCNCC2)CC1
InChIInChI=1S/C17H33N3O/c1-4-20-11-7-16(8-12-20)19(3)17(21)13-14(2)15-5-9-18-10-6-15/h14-16,18H,4-13H2,1-3H3
InChIKeyGMBMLEYTKNIBFD-UHFFFAOYSA-N
MW295.47 g/mol
LogP1.95
Rot. Bonds5

About N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide

N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide (PubChem CID 119841958) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
PubChem CID119841958
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
SMILESCCN1CCC(N(C)C(=O)CC(C)C2CCNCC2)CC1
InChIInChI=1S/C17H33N3O/c1-4-20-11-7-16(8-12-20)19(3)17(21)13-14(2)15-5-9-18-10-6-15/h14-16,18H,4-13H2,1-3H3
InChIKeyGMBMLEYTKNIBFD-UHFFFAOYSA-N
XLogP1.95
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethyl-3-methylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119893449
N-(4,4-dimethylcyclohexyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119791939
N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide
CID 119717321
N-cyclopropyl-N-ethyl-3-piperidin-4-ylbutanamide
CID 119718930
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119746206
N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
CID 119859562
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
CID 60724468
N-(1-benzylpiperidin-3-yl)-N-methyl-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119857579
N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
CID 79192601
N-(2-methylpropyl)-N-pentan-3-yl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119816024
N-ethyl-N-(2-methylpropyl)-3-piperidin-4-ylbutanamide
CID 119732319

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide (CID 119841958) is N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide is CCN1CCC(N(C)C(=O)CC(C)C2CCNCC2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide?
The InChIKey is GMBMLEYTKNIBFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-4-20-11-7-16(8-12-20)19(3)17(21)13-14(2)15-5-9-18-10-6-15/h14-16,18H,4-13H2,1-3H3.
What are the key properties of N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide?
N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide has a molecular weight of 295.47 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119841958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).