N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide

C13H26N2O2 — CID 114511157

IUPACN-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide
SMILESCCC(C)NC(=O)CN1CCC(O)C(CC)C1
InChIInChI=1S/C13H26N2O2/c1-4-10(3)14-13(17)9-15-7-6-12(16)11(5-2)8-15/h10-12,16H,4-9H2,1-3H3,(H,14,17)
InChIKeyRNUJEEPRJMXMKV-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.99
Rot. Bonds5

About N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide

N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide (PubChem CID 114511157) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide
PubChem CID114511157
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide
SMILESCCC(C)NC(=O)CN1CCC(O)C(CC)C1
InChIInChI=1S/C13H26N2O2/c1-4-10(3)14-13(17)9-15-7-6-12(16)11(5-2)8-15/h10-12,16H,4-9H2,1-3H3,(H,14,17)
InChIKeyRNUJEEPRJMXMKV-UHFFFAOYSA-N
XLogP0.99
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-butan-2-yl]-2-[(3S)-3-hydroxypyrrolidin-1-yl]acetamide
CID 129368574
2-(3-ethyl-4-hydroxypiperidin-1-yl)-N-methylacetamide
CID 114511071
methyl 1-[2-(butan-2-ylamino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 112730592
N-(cyclopropylmethyl)-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide
CID 114510904
3-(3-ethyl-4-hydroxypiperidin-1-yl)-N-propan-2-ylpropanamide
CID 114511182
N-heptan-2-yl-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114681350
N-ethyl-2-(3-ethyl-4-hydroxypiperidin-1-yl)-N-methylacetamide
CID 114510921
N-heptan-2-yl-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898417
N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
CID 63852912
(3R,4S)-1,3-diethylpiperidin-4-ol
CID 129380803
3-ethyl-1-(2-methylidenebutyl)piperidin-4-ol
CID 114511194
1-[2-oxo-2-(pentan-2-ylamino)ethyl]piperidine-3-carboxylic acid
CID 43385895

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide?
The IUPAC name of N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide (CID 114511157) is N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide?
The canonical SMILES for N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide is CCC(C)NC(=O)CN1CCC(O)C(CC)C1.
What is the InChIKey of N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide?
The InChIKey is RNUJEEPRJMXMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-10(3)14-13(17)9-15-7-6-12(16)11(5-2)8-15/h10-12,16H,4-9H2,1-3H3,(H,14,17).
What are the key properties of N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide?
N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide has a molecular weight of 242.36 g/mol, XLogP of 0.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide is sourced from PubChem (CID 114511157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).