3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide

C19H17NO2 — CID 790572

IUPAC3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C19H17NO2/c1-13-7-9-16(10-8-13)20-19(21)17-11-14-5-3-4-6-15(14)12-18(17)22-2/h3-12H,1-2H3,(H,20,21)
InChIKeyUEAMJCFZTDEOAL-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.41
Rot. Bonds3

About 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide

3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide (PubChem CID 790572) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide
PubChem CID790572
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C19H17NO2/c1-13-7-9-16(10-8-13)20-19(21)17-11-14-5-3-4-6-15(14)12-18(17)22-2/h3-12H,1-2H3,(H,20,21)
InChIKeyUEAMJCFZTDEOAL-UHFFFAOYSA-N
XLogP4.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide (CID 790572) is 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)Nc1ccc(C)cc1.
What is the InChIKey of 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide?
The InChIKey is UEAMJCFZTDEOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-13-7-9-16(10-8-13)20-19(21)17-11-14-5-3-4-6-15(14)12-18(17)22-2/h3-12H,1-2H3,(H,20,21).
What are the key properties of 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide?
3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(4-methylphenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 790572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).