2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide

C21H22N2O — CID 26506452

IUPAC2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc2ccccc2c1
InChIInChI=1S/C21H22N2O/c1-15(2)19-9-5-6-10-20(19)23-21(24)14-22-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,22H,14H2,1-2H3,(H,23,24)
InChIKeyQDXOTTIHRBDXQH-UHFFFAOYSA-N
MW318.42 g/mol
LogP5.01
Rot. Bonds5

About 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide

2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 26506452) has the molecular formula C21H22N2O and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID26506452
Molecular FormulaC21H22N2O
Molecular Weight318.42 g/mol
Exact Mass318.17
IUPAC Name2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc2ccccc2c1
InChIInChI=1S/C21H22N2O/c1-15(2)19-9-5-6-10-20(19)23-21(24)14-22-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,22H,14H2,1-2H3,(H,23,24)
InChIKeyQDXOTTIHRBDXQH-UHFFFAOYSA-N
XLogP5.01
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.42
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide (CID 26506452) is 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CNc1ccc2ccccc2c1.
What is the InChIKey of 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is QDXOTTIHRBDXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O/c1-15(2)19-9-5-6-10-20(19)23-21(24)14-22-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,22H,14H2,1-2H3,(H,23,24).
What are the key properties of 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide?
2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 5.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 26506452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).