N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide

C12H18N2O2 — CID 61242673

IUPACN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESCCC(=O)N(CCOC)Cc1ccccn1
InChIInChI=1S/C12H18N2O2/c1-3-12(15)14(8-9-16-2)10-11-6-4-5-7-13-11/h4-7H,3,8-10H2,1-2H3
InChIKeyHFSOMNNWCTWCLF-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.47
Rot. Bonds6

About N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide

N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 61242673) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
PubChem CID61242673
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESCCC(=O)N(CCOC)Cc1ccccn1
InChIInChI=1S/C12H18N2O2/c1-3-12(15)14(8-9-16-2)10-11-6-4-5-7-13-11/h4-7H,3,8-10H2,1-2H3
InChIKeyHFSOMNNWCTWCLF-UHFFFAOYSA-N
XLogP1.47
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide (CID 61242673) is N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide is CCC(=O)N(CCOC)Cc1ccccn1.
What is the InChIKey of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is HFSOMNNWCTWCLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-12(15)14(8-9-16-2)10-11-6-4-5-7-13-11/h4-7H,3,8-10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide?
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 222.29 g/mol, XLogP of 1.47, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 61242673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).