3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide

C20H19NO2 — CID 705930

IUPAC3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NCCc1ccccc1
InChIInChI=1S/C20H19NO2/c1-23-19-14-17-10-6-5-9-16(17)13-18(19)20(22)21-12-11-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3,(H,21,22)
InChIKeyCIEKVLYQBREOOO-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.82
Rot. Bonds5

About 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide

3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide (PubChem CID 705930) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide
PubChem CID705930
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NCCc1ccccc1
InChIInChI=1S/C20H19NO2/c1-23-19-14-17-10-6-5-9-16(17)13-18(19)20(22)21-12-11-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3,(H,21,22)
InChIKeyCIEKVLYQBREOOO-UHFFFAOYSA-N
XLogP3.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide (CID 705930) is 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)NCCc1ccccc1.
What is the InChIKey of 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide?
The InChIKey is CIEKVLYQBREOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-23-19-14-17-10-6-5-9-16(17)13-18(19)20(22)21-12-11-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3,(H,21,22).
What are the key properties of 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide?
3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-phenylethyl)naphthalene-2-carboxamide is sourced from PubChem (CID 705930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).