N-(2-ethoxyphenyl)naphthalene-1-carboxamide

C19H17NO2 — CID 835989

IUPACN-(2-ethoxyphenyl)naphthalene-1-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c1-2-22-18-13-6-5-12-17(18)20-19(21)16-11-7-9-14-8-3-4-10-15(14)16/h3-13H,2H2,1H3,(H,20,21)
InChIKeyYKQATDQRMJRCNK-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.49
Rot. Bonds4

About N-(2-ethoxyphenyl)naphthalene-1-carboxamide

N-(2-ethoxyphenyl)naphthalene-1-carboxamide (PubChem CID 835989) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)naphthalene-1-carboxamide
PubChem CID835989
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC NameN-(2-ethoxyphenyl)naphthalene-1-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c1-2-22-18-13-6-5-12-17(18)20-19(21)16-11-7-9-14-8-3-4-10-15(14)16/h3-13H,2H2,1H3,(H,20,21)
InChIKeyYKQATDQRMJRCNK-UHFFFAOYSA-N
XLogP4.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)naphthalene-1-carboxamide (CID 835989) is N-(2-ethoxyphenyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)naphthalene-1-carboxamide is CCOc1ccccc1NC(=O)c1cccc2ccccc12.
What is the InChIKey of N-(2-ethoxyphenyl)naphthalene-1-carboxamide?
The InChIKey is YKQATDQRMJRCNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-2-22-18-13-6-5-12-17(18)20-19(21)16-11-7-9-14-8-3-4-10-15(14)16/h3-13H,2H2,1H3,(H,20,21).
What are the key properties of N-(2-ethoxyphenyl)naphthalene-1-carboxamide?
N-(2-ethoxyphenyl)naphthalene-1-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)naphthalene-1-carboxamide is sourced from PubChem (CID 835989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).