N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide

C19H18N2O2 — CID 18167281

IUPACN-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
SMILESCOc1cc(CNC(=O)Cc2ccc3ccccc3c2)ccn1
InChIInChI=1S/C19H18N2O2/c1-23-19-12-15(8-9-20-19)13-21-18(22)11-14-6-7-16-4-2-3-5-17(16)10-14/h2-10,12H,11,13H2,1H3,(H,21,22)
InChIKeyPHVDXZWAODZYDD-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.10
Rot. Bonds5

About N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide

N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide (PubChem CID 18167281) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
PubChem CID18167281
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
SMILESCOc1cc(CNC(=O)Cc2ccc3ccccc3c2)ccn1
InChIInChI=1S/C19H18N2O2/c1-23-19-12-15(8-9-20-19)13-21-18(22)11-14-6-7-16-4-2-3-5-17(16)10-14/h2-10,12H,11,13H2,1H3,(H,21,22)
InChIKeyPHVDXZWAODZYDD-UHFFFAOYSA-N
XLogP3.10
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide (CID 18167281) is N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide is COc1cc(CNC(=O)Cc2ccc3ccccc3c2)ccn1.
What is the InChIKey of N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide?
The InChIKey is PHVDXZWAODZYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-23-19-12-15(8-9-20-19)13-21-18(22)11-14-6-7-16-4-2-3-5-17(16)10-14/h2-10,12H,11,13H2,1H3,(H,21,22).
What are the key properties of N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide?
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide has a molecular weight of 306.37 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 18167281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).