N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide

C12H24N2O3 — CID 79249727

IUPACN-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide
SMILESCC(C)[C@@H](CO)NC(=O)COC1CCNCC1
InChIInChI=1S/C12H24N2O3/c1-9(2)11(7-15)14-12(16)8-17-10-3-5-13-6-4-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)/t11-/m1/s1
InChIKeySLGBTMUGDAQNQJ-LLVKDONJSA-N
MW244.33 g/mol
LogP-0.11
Rot. Bonds6

About N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide

N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide (PubChem CID 79249727) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide
PubChem CID79249727
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide
SMILESCC(C)[C@@H](CO)NC(=O)COC1CCNCC1
InChIInChI=1S/C12H24N2O3/c1-9(2)11(7-15)14-12(16)8-17-10-3-5-13-6-4-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)/t11-/m1/s1
InChIKeySLGBTMUGDAQNQJ-LLVKDONJSA-N
XLogP-0.11
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide (CID 79249727) is N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide is CC(C)[C@@H](CO)NC(=O)COC1CCNCC1.
What is the InChIKey of N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide?
The InChIKey is SLGBTMUGDAQNQJ-LLVKDONJSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-9(2)11(7-15)14-12(16)8-17-10-3-5-13-6-4-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)/t11-/m1/s1.
What are the key properties of N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide?
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide has a molecular weight of 244.33 g/mol, XLogP of -0.11, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 79249727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).