N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide

C14H21N3O2 — CID 79281792

IUPACN-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCOCCNCC(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C14H21N3O2/c1-19-9-8-15-10-14(18)17(13-5-6-13)11-12-4-2-3-7-16-12/h2-4,7,13,15H,5-6,8-11H2,1H3
InChIKeyYAFLLSADTOIYDH-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.81
Rot. Bonds8

About N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide

N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 79281792) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID79281792
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCOCCNCC(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C14H21N3O2/c1-19-9-8-15-10-14(18)17(13-5-6-13)11-12-4-2-3-7-16-12/h2-4,7,13,15H,5-6,8-11H2,1H3
InChIKeyYAFLLSADTOIYDH-UHFFFAOYSA-N
XLogP0.81
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide (CID 79281792) is N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide is COCCNCC(=O)N(Cc1ccccn1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is YAFLLSADTOIYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-19-9-8-15-10-14(18)17(13-5-6-13)11-12-4-2-3-7-16-12/h2-4,7,13,15H,5-6,8-11H2,1H3.
What are the key properties of N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide?
N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 263.34 g/mol, XLogP of 0.81, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 79281792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).