N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide

C14H28N2O2 — CID 106255561

IUPACN-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide
SMILESCCC(CC)(CO)CNC(=O)CC1CCCNC1
InChIInChI=1S/C14H28N2O2/c1-3-14(4-2,11-17)10-16-13(18)8-12-6-5-7-15-9-12/h12,15,17H,3-11H2,1-2H3,(H,16,18)
InChIKeyNAVLBPZRJZRFHO-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.29
Rot. Bonds7

About N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide

N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide (PubChem CID 106255561) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide
PubChem CID106255561
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide
SMILESCCC(CC)(CO)CNC(=O)CC1CCCNC1
InChIInChI=1S/C14H28N2O2/c1-3-14(4-2,11-17)10-16-13(18)8-12-6-5-7-15-9-12/h12,15,17H,3-11H2,1-2H3,(H,16,18)
InChIKeyNAVLBPZRJZRFHO-UHFFFAOYSA-N
XLogP1.29
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-difluoro-3-hydroxypropyl)-2-piperidin-3-ylacetamide
CID 106176991
(3S)-N-[2-ethyl-2-(hydroxymethyl)butyl]piperidine-3-carboxamide
CID 114164701
N-(2-hydroxyethyl)-2-piperidin-3-ylacetamide
CID 22929447
N-(4-hydroxy-2-methylbutyl)-2-piperidin-3-ylacetamide
CID 66091830
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-4-ylsulfanylacetamide
CID 106255078
N-(2-hydroxypropyl)-2-piperidin-3-ylacetamide
CID 62674871
N-(2-ethoxyethyl)-2-piperidin-3-ylacetamide
CID 62689521
N-(5-hydroxy-2,2-dimethylpentyl)-2-pyrrolidin-3-ylacetamide
CID 106148292
N-(2,3-dihydroxypropyl)-2-piperidin-3-ylacetamide
CID 66170381
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-(oxan-2-yl)acetamide
CID 103843667
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-piperidin-3-ylacetamide
CID 62690196
2-cyclopropyl-N-(2-piperidin-3-ylethyl)acetamide
CID 63628201

Frequently Asked Questions

What is the IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide (CID 106255561) is N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide is CCC(CC)(CO)CNC(=O)CC1CCCNC1.
What is the InChIKey of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide?
The InChIKey is NAVLBPZRJZRFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-14(4-2,11-17)10-16-13(18)8-12-6-5-7-15-9-12/h12,15,17H,3-11H2,1-2H3,(H,16,18).
What are the key properties of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide?
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide has a molecular weight of 256.39 g/mol, XLogP of 1.29, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 106255561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).