2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride

C14H22Cl2N4O2 — CID 119882864

IUPAC2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride
SMILESCOCCNCC(=O)NCc1cn2c(C)cccc2n1.Cl.Cl
InChIInChI=1S/C14H20N4O2.2ClH/c1-11-4-3-5-13-17-12(10-18(11)13)8-16-14(19)9-15-6-7-20-2;;/h3-5,10,15H,6-9H2,1-2H3,(H,16,19);2*1H
InChIKeyPGUGAYRWAVJSTQ-UHFFFAOYSA-N
MW349.26 g/mol
LogP1.34
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride

2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride (PubChem CID 119882864) has the molecular formula C14H22Cl2N4O2 and a molecular weight of 349.26 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride
PubChem CID119882864
Molecular FormulaC14H22Cl2N4O2
Molecular Weight349.26 g/mol
Exact Mass348.11
IUPAC Name2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride
SMILESCOCCNCC(=O)NCc1cn2c(C)cccc2n1.Cl.Cl
InChIInChI=1S/C14H20N4O2.2ClH/c1-11-4-3-5-13-17-12(10-18(11)13)8-16-14(19)9-15-6-7-20-2;;/h3-5,10,15H,6-9H2,1-2H3,(H,16,19);2*1H
InChIKeyPGUGAYRWAVJSTQ-UHFFFAOYSA-N
XLogP1.34
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.26
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride (CID 119882864) is 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride is COCCNCC(=O)NCc1cn2c(C)cccc2n1.Cl.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride?
The InChIKey is PGUGAYRWAVJSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2.2ClH/c1-11-4-3-5-13-17-12(10-18(11)13)8-16-14(19)9-15-6-7-20-2;;/h3-5,10,15H,6-9H2,1-2H3,(H,16,19);2*1H.
What are the key properties of 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride?
2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride has a molecular weight of 349.26 g/mol, XLogP of 1.34, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride is sourced from PubChem (CID 119882864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).