N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide

C15H23NO2 — CID 166943636

IUPACN-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide
SMILESO=C(CC12CC3CC4CC(C1)C2(C4)C3)NCCO
InChIInChI=1S/C15H23NO2/c17-2-1-16-13(18)9-14-5-11-3-10-4-12(8-14)15(14,6-10)7-11/h10-12,17H,1-9H2,(H,16,18)
InChIKeyWIQUENRJZDBQKN-UHFFFAOYSA-N
MW249.35 g/mol
LogP1.70
Rot. Bonds4

About N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide

N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide (PubChem CID 166943636) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide
PubChem CID166943636
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide
SMILESO=C(CC12CC3CC4CC(C1)C2(C4)C3)NCCO
InChIInChI=1S/C15H23NO2/c17-2-1-16-13(18)9-14-5-11-3-10-4-12(8-14)15(14,6-10)7-11/h10-12,17H,1-9H2,(H,16,18)
InChIKeyWIQUENRJZDBQKN-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide (CID 166943636) is N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide is O=C(CC12CC3CC4CC(C1)C2(C4)C3)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide?
The InChIKey is WIQUENRJZDBQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c17-2-1-16-13(18)9-14-5-11-3-10-4-12(8-14)15(14,6-10)7-11/h10-12,17H,1-9H2,(H,16,18).
What are the key properties of N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide?
N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide has a molecular weight of 249.35 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(3-tetracyclo[5.3.1.03,9.05,9]undecanyl)acetamide is sourced from PubChem (CID 166943636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).