N-[(1-acetylpiperidin-4-yl)methyl]pentanamide

C13H24N2O2 — CID 110736125

IUPACN-[(1-acetylpiperidin-4-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCN(C(C)=O)CC1
InChIInChI=1S/C13H24N2O2/c1-3-4-5-13(17)14-10-12-6-8-15(9-7-12)11(2)16/h12H,3-10H2,1-2H3,(H,14,17)
InChIKeyDTYGYSHBDKJUPG-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.55
Rot. Bonds5

About N-[(1-acetylpiperidin-4-yl)methyl]pentanamide

N-[(1-acetylpiperidin-4-yl)methyl]pentanamide (PubChem CID 110736125) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(1-acetylpiperidin-4-yl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(1-acetylpiperidin-4-yl)methyl]pentanamide
PubChem CID110736125
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[(1-acetylpiperidin-4-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCN(C(C)=O)CC1
InChIInChI=1S/C13H24N2O2/c1-3-4-5-13(17)14-10-12-6-8-15(9-7-12)11(2)16/h12H,3-10H2,1-2H3,(H,14,17)
InChIKeyDTYGYSHBDKJUPG-UHFFFAOYSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-aminocyclohexyl)methyl]pentanamide
CID 106124302
4-[(pentanoylamino)methyl]cyclohexane-1-carboxylic acid
CID 21470545
N-(1-acetylpyrrolidin-3-yl)pentanamide
CID 110871326
N-[(3-chlorocyclopentyl)methyl]pentanamide
CID 106127433
N-[(4-chlorocyclohexyl)methyl]octanamide
CID 106133761
N-[(1-acetylpiperidin-4-yl)methyl]-3-(2-methylphenyl)propanamide
CID 110736193
N-[[1-[2-(dimethylamino)-2-oxoethyl]piperidin-4-yl]methyl]octanamide
CID 122158507
N-[(1-acetylpyrrolidin-3-yl)methyl]-4-oxo-4-pyrrolidin-1-ylbutanamide
CID 177056527
1-[4-(methylaminomethyl)piperidin-1-yl]ethanone
CID 22983130
N-(piperidin-4-ylmethyl)heptanamide
CID 115736684
5-[4-(methylaminomethyl)piperidin-1-yl]-5-oxo-N-propylpentanamide
CID 119546405
1-(4-heptylpiperidin-1-yl)ethanone
CID 155216374

Frequently Asked Questions

What is the IUPAC name of N-[(1-acetylpiperidin-4-yl)methyl]pentanamide?
The IUPAC name of N-[(1-acetylpiperidin-4-yl)methyl]pentanamide (CID 110736125) is N-[(1-acetylpiperidin-4-yl)methyl]pentanamide.
What is the SMILES notation for N-[(1-acetylpiperidin-4-yl)methyl]pentanamide?
The canonical SMILES for N-[(1-acetylpiperidin-4-yl)methyl]pentanamide is CCCCC(=O)NCC1CCN(C(C)=O)CC1.
What is the InChIKey of N-[(1-acetylpiperidin-4-yl)methyl]pentanamide?
The InChIKey is DTYGYSHBDKJUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-4-5-13(17)14-10-12-6-8-15(9-7-12)11(2)16/h12H,3-10H2,1-2H3,(H,14,17).
What are the key properties of N-[(1-acetylpiperidin-4-yl)methyl]pentanamide?
N-[(1-acetylpiperidin-4-yl)methyl]pentanamide has a molecular weight of 240.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-acetylpiperidin-4-yl)methyl]pentanamide is sourced from PubChem (CID 110736125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).