6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide

C20H25N3O4 — CID 109094634

IUPAC6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide
SMILESCCC(C)NC(=O)c1cccc(C(=O)NCCOc2ccc(OC)cc2)n1
InChIInChI=1S/C20H25N3O4/c1-4-14(2)22-20(25)18-7-5-6-17(23-18)19(24)21-12-13-27-16-10-8-15(26-3)9-11-16/h5-11,14H,4,12-13H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyNIKIYMQRTUHTMN-UHFFFAOYSA-N
MW371.44 g/mol
LogP2.43
Rot. Bonds9

About 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide

6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide (PubChem CID 109094634) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide
PubChem CID109094634
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC Name6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide
SMILESCCC(C)NC(=O)c1cccc(C(=O)NCCOc2ccc(OC)cc2)n1
InChIInChI=1S/C20H25N3O4/c1-4-14(2)22-20(25)18-7-5-6-17(23-18)19(24)21-12-13-27-16-10-8-15(26-3)9-11-16/h5-11,14H,4,12-13H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyNIKIYMQRTUHTMN-UHFFFAOYSA-N
XLogP2.43
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide 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-butan-2-yl-6-methoxypyridine-2-carboxamide
CID 110848498
N-[2-(4-methoxyphenoxy)ethyl]-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573585
N-butan-2-yl-6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]pyridine-2-carboxamide
CID 109094649
1-ethyl-N-[2-(4-methoxyphenoxy)ethyl]-6-oxopyridazine-3-carboxamide
CID 121066856
6-methyl-N-[2-(4-methylphenoxy)ethyl]pyridine-2-carboxamide
CID 38450854
6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 109094593
6-N-butan-2-yl-2-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093809
6-N-[2-(4-methoxyphenyl)ethyl]-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
CID 109095851
N-butan-2-yl-4-(4-methoxyphenoxy)butanamide
CID 19175097
6-(2-propan-2-yloxyethylcarbamoyl)pyridine-2-carboxylic acid
CID 104764713
3-bromo-N-[2-(4-methoxyphenoxy)ethyl]benzamide
CID 27173443
N-butan-2-yl-4-(2-methoxyethoxy)benzamide
CID 17137424

Frequently Asked Questions

What is the IUPAC name of 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide (CID 109094634) is 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide is CCC(C)NC(=O)c1cccc(C(=O)NCCOc2ccc(OC)cc2)n1.
What is the InChIKey of 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide?
The InChIKey is NIKIYMQRTUHTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-4-14(2)22-20(25)18-7-5-6-17(23-18)19(24)21-12-13-27-16-10-8-15(26-3)9-11-16/h5-11,14H,4,12-13H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide?
6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide has a molecular weight of 371.44 g/mol, XLogP of 2.43, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109094634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).