N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide

C19H17NO2 — CID 66596351

IUPACN-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide
SMILESCOc1cc(C)ccc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c1-13-10-11-17(18(12-13)22-2)20-19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-12H,1-2H3,(H,20,21)
InChIKeyLZGPYXSMCJNNHD-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.41
Rot. Bonds3

About N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide

N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide (PubChem CID 66596351) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide
PubChem CID66596351
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC NameN-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide
SMILESCOc1cc(C)ccc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c1-13-10-11-17(18(12-13)22-2)20-19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-12H,1-2H3,(H,20,21)
InChIKeyLZGPYXSMCJNNHD-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 N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide (CID 66596351) is N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide is COc1cc(C)ccc1NC(=O)c1cccc2ccccc12.
What is the InChIKey of N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide?
The InChIKey is LZGPYXSMCJNNHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-13-10-11-17(18(12-13)22-2)20-19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-12H,1-2H3,(H,20,21).
What are the key properties of N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide?
N-(2-methoxy-4-methylphenyl)naphthalene-1-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 N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide is sourced from PubChem (CID 66596351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).