2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

C19H18N2O — CID 70824003

IUPAC2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESN#CCC(=O)NC1Cc2ccccc2C(c2ccccc2)C1
InChIInChI=1S/C19H18N2O/c20-11-10-19(22)21-16-12-15-8-4-5-9-17(15)18(13-16)14-6-2-1-3-7-14/h1-9,16,18H,10,12-13H2,(H,21,22)
InChIKeyKJXCVYHKEZPYIX-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.16
Rot. Bonds3

About 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (PubChem CID 70824003) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.

Molecular Properties

Compound Name2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
PubChem CID70824003
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESN#CCC(=O)NC1Cc2ccccc2C(c2ccccc2)C1
InChIInChI=1S/C19H18N2O/c20-11-10-19(22)21-16-12-15-8-4-5-9-17(15)18(13-16)14-6-2-1-3-7-14/h1-9,16,18H,10,12-13H2,(H,21,22)
InChIKeyKJXCVYHKEZPYIX-UHFFFAOYSA-N
XLogP3.16
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The IUPAC name of 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (CID 70824003) is 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.
What is the SMILES notation for 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The canonical SMILES for 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is N#CCC(=O)NC1Cc2ccccc2C(c2ccccc2)C1.
What is the InChIKey of 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The InChIKey is KJXCVYHKEZPYIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c20-11-10-19(22)21-16-12-15-8-4-5-9-17(15)18(13-16)14-6-2-1-3-7-14/h1-9,16,18H,10,12-13H2,(H,21,22).
What are the key properties of 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide has a molecular weight of 290.37 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is sourced from PubChem (CID 70824003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).