1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one

C13H22N2O2 — CID 43733486

IUPAC1-(2-methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one
SMILESCCCC(C)NC1=CN(C(=O)C=C1)CCOC
InChIInChI=1S/C13H22N2O2/c1-4-5-11(2)14-12-6-7-13(16)15(10-12)8-9-17-3/h6-7,10-11,14H,4-5,8-9H2,1-3H3
InChIKeyAPYLCITTXQJLIG-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.60
Rot. Bonds7

About 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one

1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one (PubChem CID 43733486) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one
PubChem CID43733486
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-(2-methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one
SMILESCCCC(C)NC1=CN(C(=O)C=C1)CCOC
InChIInChI=1S/C13H22N2O2/c1-4-5-11(2)14-12-6-7-13(16)15(10-12)8-9-17-3/h6-7,10-11,14H,4-5,8-9H2,1-3H3
InChIKeyAPYLCITTXQJLIG-UHFFFAOYSA-N
XLogP1.60
TPSA41.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity311

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one 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

CID 20117994
CID 20117994
CID 71784685
CID 71784685
CID 62733372
CID 62733372
CID 81318595
CID 81318595
CID 81319658
CID 81319658
CID 81320114
CID 81320114
CID 102868855
CID 102868855
CID 103514984
CID 103514984
CID 107506369
CID 107506369
CID 107506371
CID 107506371
CID 116534445
CID 116534445
CID 63697075
CID 63697075

Frequently Asked Questions

What is the IUPAC name of 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one?
The IUPAC name of 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one (CID 43733486) is 1-(2-methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one.
What is the SMILES notation for 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one?
The canonical SMILES for 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one is CCCC(C)NC1=CN(C(=O)C=C1)CCOC.
What is the InChIKey of 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one?
The InChIKey is APYLCITTXQJLIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-5-11(2)14-12-6-7-13(16)15(10-12)8-9-17-3/h6-7,10-11,14H,4-5,8-9H2,1-3H3.
What are the key properties of 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one?
1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one has a molecular weight of 238.33 g/mol, XLogP of 1.60, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-Methoxyethyl)-5-(pentan-2-ylamino)pyridin-2-one is sourced from PubChem (CID 43733486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).