N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide

C17H28N2O2 — CID 11601752

IUPACN-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)CC1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H28N2O2/c20-15-1-3-19(4-2-15)11-16(21)18-17-8-12-5-13(9-17)7-14(6-12)10-17/h12-15,20H,1-11H2,(H,18,21)
InChIKeyXXFWDBSGTQINNB-UHFFFAOYSA-N
MW292.42 g/mol
LogP1.53
Rot. Bonds3

About N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide

N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide (PubChem CID 11601752) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide
PubChem CID11601752
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)CC1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H28N2O2/c20-15-1-3-19(4-2-15)11-16(21)18-17-8-12-5-13(9-17)7-14(6-12)10-17/h12-15,20H,1-11H2,(H,18,21)
InChIKeyXXFWDBSGTQINNB-UHFFFAOYSA-N
XLogP1.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide?
The IUPAC name of N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide (CID 11601752) is N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide?
The canonical SMILES for N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide is O=C(CN1CCC(O)CC1)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide?
The InChIKey is XXFWDBSGTQINNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c20-15-1-3-19(4-2-15)11-16(21)18-17-8-12-5-13(9-17)7-14(6-12)10-17/h12-15,20H,1-11H2,(H,18,21).
What are the key properties of N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide?
N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide has a molecular weight of 292.42 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-(4-hydroxypiperidin-1-yl)acetamide is sourced from PubChem (CID 11601752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).