2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide

C17H21N3O2 — CID 109166864

IUPAC2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
SMILESCOCCNc1cc(C(=O)NC(C)c2ccccc2)ccn1
InChIInChI=1S/C17H21N3O2/c1-13(14-6-4-3-5-7-14)20-17(21)15-8-9-18-16(12-15)19-10-11-22-2/h3-9,12-13H,10-11H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyHIYHEXOGWHXSFD-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.63
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide

2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide (PubChem CID 109166864) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
PubChem CID109166864
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
SMILESCOCCNc1cc(C(=O)NC(C)c2ccccc2)ccn1
InChIInChI=1S/C17H21N3O2/c1-13(14-6-4-3-5-7-14)20-17(21)15-8-9-18-16(12-15)19-10-11-22-2/h3-9,12-13H,10-11H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyHIYHEXOGWHXSFD-UHFFFAOYSA-N
XLogP2.63
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 ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109168033
2-(butan-2-ylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109165889
2-[2-(cyclohexen-1-yl)ethylamino]-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109166653
2-(oxolan-2-ylmethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109167544
2-(3,4-dimethoxyanilino)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109170096
2-(aminomethyl)-N-[(1S)-1-phenylethyl]pyridine-4-carboxamide
CID 114326595
2-fluoro-N-[(1S)-1-phenylethyl]pyridine-4-carboxamide
CID 113233055
4-(1-phenylethylcarbamoyl)pyridine-2-carboxylic acid
CID 115730036
methyl N-[[4-(1-phenylethylcarbamoyl)-2-pyridinyl]methyl]carbamate
CID 112520281
methyl 2-[[2-(2-methoxyethylamino)pyridine-4-carbonyl]amino]benzoate
CID 109166947
N-(2,6-diethylphenyl)-2-(2-methoxyethylamino)pyridine-4-carboxamide
CID 109166921
2-(3-bromoanilino)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 109170111

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide (CID 109166864) is 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide is COCCNc1cc(C(=O)NC(C)c2ccccc2)ccn1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?
The InChIKey is HIYHEXOGWHXSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13(14-6-4-3-5-7-14)20-17(21)15-8-9-18-16(12-15)19-10-11-22-2/h3-9,12-13H,10-11H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?
2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 2.63, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109166864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).