N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide

C18H23N3O3 — CID 109153204

IUPACN-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(NCCCOC)nc2)cc1
InChIInChI=1S/C18H23N3O3/c1-3-24-16-8-6-15(7-9-16)21-18(22)14-5-10-17(20-13-14)19-11-4-12-23-2/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyQALVUMGMQPMTQE-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.18
Rot. Bonds9

About N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide

N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide (PubChem CID 109153204) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
PubChem CID109153204
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(NCCCOC)nc2)cc1
InChIInChI=1S/C18H23N3O3/c1-3-24-16-8-6-15(7-9-16)21-18(22)14-5-10-17(20-13-14)19-11-4-12-23-2/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyQALVUMGMQPMTQE-UHFFFAOYSA-N
XLogP3.18
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide 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-(4-acetamidophenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153217
methyl 4-[[6-(3-methoxypropylamino)pyridine-3-carbonyl]amino]benzoate
CID 109153220
N-[4-(diethylamino)phenyl]-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153224
4-tert-butyl-N-[6-(3-methoxypropylamino)-3-pyridinyl]benzamide
CID 113010472
N-(3-acetamidophenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153216
methyl 4-[[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164188
6-(4-acetamidoanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164185
4-methoxy-N-[6-[2-(4-methoxyphenoxy)ethylamino]-3-pyridinyl]benzamide
CID 113014697
2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide
CID 3252781
6-(butylamino)-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109151550
6-(3-methoxypropylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109151323
N-(4-tert-butylphenyl)-6-(pentylamino)pyridine-3-carboxamide
CID 109161313

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide (CID 109153204) is N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide is CCOc1ccc(NC(=O)c2ccc(NCCCOC)nc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide?
The InChIKey is QALVUMGMQPMTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-3-24-16-8-6-15(7-9-16)21-18(22)14-5-10-17(20-13-14)19-11-4-12-23-2/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,20)(H,21,22).
What are the key properties of N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide?
N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 3.18, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109153204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).