N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide

C22H24N2O3 — CID 55707854

IUPACN-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide
SMILESCCOc1cc(CNC(=O)CCCOc2cccc3ccccc23)ccn1
InChIInChI=1S/C22H24N2O3/c1-2-26-22-15-17(12-13-23-22)16-24-21(25)11-6-14-27-20-10-5-8-18-7-3-4-9-19(18)20/h3-5,7-10,12-13,15H,2,6,11,14,16H2,1H3,(H,24,25)
InChIKeyYQGKOYWNKFORFK-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.11
Rot. Bonds9

About N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide

N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide (PubChem CID 55707854) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound NameN-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide
PubChem CID55707854
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide
SMILESCCOc1cc(CNC(=O)CCCOc2cccc3ccccc23)ccn1
InChIInChI=1S/C22H24N2O3/c1-2-26-22-15-17(12-13-23-22)16-24-21(25)11-6-14-27-20-10-5-8-18-7-3-4-9-19(18)20/h3-5,7-10,12-13,15H,2,6,11,14,16H2,1H3,(H,24,25)
InChIKeyYQGKOYWNKFORFK-UHFFFAOYSA-N
XLogP4.11
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-benzyl-4-(2-ethoxyphenoxy)butanamide
CID 78774394
N-[[4-(dimethylamino)phenyl]methyl]-4-naphthalen-1-yloxybutanamide
CID 46469275
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-naphthalen-1-ylacetamide
CID 55888076
4-amino-N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]butanamide
CID 119847529
ethyl 2-(6-naphthalen-1-yloxyhexanoylamino)acetate
CID 122182969
N-[(2-ethoxy-4-pyridinyl)methyl]-1-benzothiophene-2-carboxamide
CID 52606280
N-[3-[[4-(2-ethoxyphenoxy)butanoylamino]methyl]phenyl]furan-2-carboxamide
CID 39228981
3-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)-N-[(2-ethoxy-4-pyridinyl)methyl]propanamide
CID 56791210
N-[(3,5-diethyl-1-methylpyrazol-4-yl)methyl]-4-naphthalen-1-yloxybutanamide
CID 138993702
N-[(2-ethoxy-4-pyridinyl)methyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 55707848
5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]pentanamide
CID 62994356
4-(2-ethoxyphenoxy)-N-ethylbutanamide
CID 78781225

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide?
The IUPAC name of N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide (CID 55707854) is N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide.
What is the SMILES notation for N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide?
The canonical SMILES for N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide is CCOc1cc(CNC(=O)CCCOc2cccc3ccccc23)ccn1.
What is the InChIKey of N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide?
The InChIKey is YQGKOYWNKFORFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-2-26-22-15-17(12-13-23-22)16-24-21(25)11-6-14-27-20-10-5-8-18-7-3-4-9-19(18)20/h3-5,7-10,12-13,15H,2,6,11,14,16H2,1H3,(H,24,25).
What are the key properties of N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide?
N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide has a molecular weight of 364.45 g/mol, XLogP of 4.11, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-4-pyridinyl)methyl]-4-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 55707854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).