N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide

C14H24N2O2 — CID 18590767

IUPACN-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide
SMILESO=C(CNCCO)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C14H24N2O2/c17-2-1-15-8-13(18)16-14-11-4-9-3-10(6-11)7-12(14)5-9/h9-12,14-15,17H,1-8H2,(H,16,18)
InChIKeyZVGCLTFESGUYAC-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.51
Rot. Bonds5

About N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide

N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide (PubChem CID 18590767) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide
PubChem CID18590767
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide
SMILESO=C(CNCCO)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C14H24N2O2/c17-2-1-15-8-13(18)16-14-11-4-9-3-10(6-11)7-12(14)5-9/h9-12,14-15,17H,1-8H2,(H,16,18)
InChIKeyZVGCLTFESGUYAC-UHFFFAOYSA-N
XLogP0.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide?
The IUPAC name of N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide (CID 18590767) is N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide.
What is the SMILES notation for N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide?
The canonical SMILES for N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide is O=C(CNCCO)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide?
The InChIKey is ZVGCLTFESGUYAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c17-2-1-15-8-13(18)16-14-11-4-9-3-10(6-11)7-12(14)5-9/h9-12,14-15,17H,1-8H2,(H,16,18).
What are the key properties of N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide?
N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide has a molecular weight of 252.36 g/mol, XLogP of 0.51, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-(2-hydroxyethylamino)acetamide is sourced from PubChem (CID 18590767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).