N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide

C13H21N3O2 — CID 60902705

IUPACN-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide
SMILESCOCCNC(=O)C(C)NCCc1ccncc1
InChIInChI=1S/C13H21N3O2/c1-11(13(17)16-9-10-18-2)15-8-5-12-3-6-14-7-4-12/h3-4,6-7,11,15H,5,8-10H2,1-2H3,(H,16,17)
InChIKeyZQZRDZYDVNYVTN-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.36
Rot. Bonds8

About N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide

N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide (PubChem CID 60902705) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide
PubChem CID60902705
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide
SMILESCOCCNC(=O)C(C)NCCc1ccncc1
InChIInChI=1S/C13H21N3O2/c1-11(13(17)16-9-10-18-2)15-8-5-12-3-6-14-7-4-12/h3-4,6-7,11,15H,5,8-10H2,1-2H3,(H,16,17)
InChIKeyZQZRDZYDVNYVTN-UHFFFAOYSA-N
XLogP0.36
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.36
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

N-(2-methoxyethyl)-2-(pyridin-4-ylmethylamino)propanamide
CID 43086931
N-(2-methoxyethyl)-2-[2-(4-methoxyphenyl)ethylamino]propanamide
CID 43087093
methyl 2-(2-pyridin-4-ylethylamino)propanoate
CID 61499767
N-(ethylcarbamoyl)-2-(2-pyridin-4-ylethylamino)propanamide
CID 60902698
N-(2-methoxyethyl)-2-[2-(3-methoxyphenyl)ethylamino]propanamide
CID 107852150
N-pentan-2-yl-2-(2-pyridin-4-ylethylamino)propanamide
CID 60903136
methyl 2-methyl-3-(2-pyridin-4-ylethylamino)butanoate
CID 79392378
(2R)-2-hydroxy-N-(2-pyridin-4-ylethyl)propanamide
CID 99965178
N-(2-methoxyethyl)-N'-(pyridin-4-ylmethyl)oxamide
CID 5077077
1-methoxy-3-methyl-N-(2-pyridin-4-ylethyl)butan-2-amine
CID 65049563
N-(2-methoxyethyl)-2-[(4-methylphenyl)methylamino]propanamide
CID 43087566
2-fluoro-N-(2-pyridin-4-ylethyl)propanamide
CID 174360560

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide?
The IUPAC name of N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide (CID 60902705) is N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide is COCCNC(=O)C(C)NCCc1ccncc1.
What is the InChIKey of N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide?
The InChIKey is ZQZRDZYDVNYVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-11(13(17)16-9-10-18-2)15-8-5-12-3-6-14-7-4-12/h3-4,6-7,11,15H,5,8-10H2,1-2H3,(H,16,17).
What are the key properties of N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide?
N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide has a molecular weight of 251.33 g/mol, XLogP of 0.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide is sourced from PubChem (CID 60902705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).