N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide

C17H21N3O2 — CID 109201237

IUPACN-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)Nc2ccccc2OCC)c1
InChIInChI=1S/C17H21N3O2/c1-3-10-18-13-9-11-19-15(12-13)17(21)20-14-7-5-6-8-16(14)22-4-2/h5-9,11-12H,3-4,10H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyXLNCZQJFWMVXIR-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.55
Rot. Bonds7

About N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide

N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide (PubChem CID 109201237) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
PubChem CID109201237
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)Nc2ccccc2OCC)c1
InChIInChI=1S/C17H21N3O2/c1-3-10-18-13-9-11-19-15(12-13)17(21)20-14-7-5-6-8-16(14)22-4-2/h5-9,11-12H,3-4,10H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyXLNCZQJFWMVXIR-UHFFFAOYSA-N
XLogP3.55
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-4-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109212895
N-(2-fluorophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62166215
N-(2-propan-2-ylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201226
N-(2-ethoxyphenyl)-4-[(2-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210117
4-(cycloheptylamino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109217163
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
4-(propylamino)-N-pyridin-2-ylpyridine-2-carboxamide
CID 55042694
4-N-(2-ethoxyphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092650
N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109221025
N-(3,5-dimethylphenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109219935
4-(2-ethoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219228
N-(3-iodophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 63499869

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide (CID 109201237) is N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)Nc2ccccc2OCC)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide?
The InChIKey is XLNCZQJFWMVXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-3-10-18-13-9-11-19-15(12-13)17(21)20-14-7-5-6-8-16(14)22-4-2/h5-9,11-12H,3-4,10H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide?
N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 3.55, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109201237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).