N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide

C14H28N2O2 — CID 114150053

IUPACN-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide
SMILESCC(C)(CCO)CNC(=O)CCC1CCNCC1
InChIInChI=1S/C14H28N2O2/c1-14(2,7-10-17)11-16-13(18)4-3-12-5-8-15-9-6-12/h12,15,17H,3-11H2,1-2H3,(H,16,18)
InChIKeyLQMXSBMSAXTTPM-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.29
Rot. Bonds7

About N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide

N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide (PubChem CID 114150053) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide
PubChem CID114150053
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide
SMILESCC(C)(CCO)CNC(=O)CCC1CCNCC1
InChIInChI=1S/C14H28N2O2/c1-14(2,7-10-17)11-16-13(18)4-3-12-5-8-15-9-6-12/h12,15,17H,3-11H2,1-2H3,(H,16,18)
InChIKeyLQMXSBMSAXTTPM-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-methoxy-2-methylpropyl)-3-piperidin-4-ylpropanamide
CID 113343490
N-(4-hydroxybutyl)-3-piperidin-4-ylpropanamide
CID 106841935
N-(5-hydroxy-2,2-dimethylpentyl)-2-pyrrolidin-3-ylacetamide
CID 106148292
3-chloro-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 106145976
2,2-dimethyl-3-(3-pyrrolidin-3-ylpropanoylamino)propanamide
CID 103859907
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-3-pyrrolidin-3-ylpropanamide
CID 106247834
N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
CID 115870643
N-(4-hydroxy-2,2-dimethylbutyl)-2-piperazin-1-ylacetamide
CID 106147925
2-[[2-(3-piperidin-4-ylpropanoylamino)acetyl]amino]acetic acid
CID 62210241
3-amino-3-cyclopropyl-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 106148074
N-[(1R)-1-cyclopentylethyl]-3-piperidin-4-ylpropanamide
CID 81390674
N-[2-(dimethylcarbamoylamino)ethyl]-3-piperidin-4-ylpropanamide
CID 83109441

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide (CID 114150053) is N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide is CC(C)(CCO)CNC(=O)CCC1CCNCC1.
What is the InChIKey of N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide?
The InChIKey is LQMXSBMSAXTTPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-14(2,7-10-17)11-16-13(18)4-3-12-5-8-15-9-6-12/h12,15,17H,3-11H2,1-2H3,(H,16,18).
What are the key properties of N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide?
N-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide 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-(4-hydroxy-2,2-dimethylbutyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 114150053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).