2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide

C25H24N2O2 — CID 156786227

IUPAC2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN(Cc2ccc3ccccc3c2)Cc2ccco2)c1
InChIInChI=1S/C25H24N2O2/c1-19-6-4-9-23(14-19)26-25(28)18-27(17-24-10-5-13-29-24)16-20-11-12-21-7-2-3-8-22(21)15-20/h2-15H,16-18H2,1H3,(H,26,28)
InChIKeyNXQNKTPFQHNZQO-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.38
Rot. Bonds7

About 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide

2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide (PubChem CID 156786227) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide
PubChem CID156786227
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN(Cc2ccc3ccccc3c2)Cc2ccco2)c1
InChIInChI=1S/C25H24N2O2/c1-19-6-4-9-23(14-19)26-25(28)18-27(17-24-10-5-13-29-24)16-20-11-12-21-7-2-3-8-22(21)15-20/h2-15H,16-18H2,1H3,(H,26,28)
InChIKeyNXQNKTPFQHNZQO-UHFFFAOYSA-N
XLogP5.38
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide (CID 156786227) is 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CN(Cc2ccc3ccccc3c2)Cc2ccco2)c1.
What is the InChIKey of 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide?
The InChIKey is NXQNKTPFQHNZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-19-6-4-9-23(14-19)26-25(28)18-27(17-24-10-5-13-29-24)16-20-11-12-21-7-2-3-8-22(21)15-20/h2-15H,16-18H2,1H3,(H,26,28).
What are the key properties of 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide?
2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide has a molecular weight of 384.48 g/mol, XLogP of 5.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-2-ylmethyl(naphthalen-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 156786227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).