2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide

C18H20N2O — CID 103767102

IUPAC2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C2C3CCC(C3)C12
InChIInChI=1S/C18H20N2O/c21-15(8-12-9-19-14-4-2-1-3-13(12)14)20-18-16-10-5-6-11(7-10)17(16)18/h1-4,9-11,16-19H,5-8H2,(H,20,21)
InChIKeyZVFYGLWDCRJCKG-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.87
Rot. Bonds3

About 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide

2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide (PubChem CID 103767102) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
PubChem CID103767102
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C2C3CCC(C3)C12
InChIInChI=1S/C18H20N2O/c21-15(8-12-9-19-14-4-2-1-3-13(12)14)20-18-16-10-5-6-11(7-10)17(16)18/h1-4,9-11,16-19H,5-8H2,(H,20,21)
InChIKeyZVFYGLWDCRJCKG-UHFFFAOYSA-N
XLogP2.87
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide (CID 103767102) is 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide is O=C(Cc1c[nH]c2ccccc12)NC1C2C3CCC(C3)C12.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide?
The InChIKey is ZVFYGLWDCRJCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-15(8-12-9-19-14-4-2-1-3-13(12)14)20-18-16-10-5-6-11(7-10)17(16)18/h1-4,9-11,16-19H,5-8H2,(H,20,21).
What are the key properties of 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide?
2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide is sourced from PubChem (CID 103767102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).