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

C13H20Cl2N4O — CID 119882818

IUPAC2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride
SMILESCc1cccc2nc(CNC(=O)C(C)(C)N)cn12.Cl.Cl
InChIInChI=1S/C13H18N4O.2ClH/c1-9-5-4-6-11-16-10(8-17(9)11)7-15-12(18)13(2,3)14;;/h4-6,8H,7,14H2,1-3H3,(H,15,18);2*1H
InChIKeyBSIACVIHBIUBMB-UHFFFAOYSA-N
MW319.24 g/mol
LogP1.84
Rot. Bonds3

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

2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride (PubChem CID 119882818) has the molecular formula C13H20Cl2N4O and a molecular weight of 319.24 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride
PubChem CID119882818
Molecular FormulaC13H20Cl2N4O
Molecular Weight319.24 g/mol
Exact Mass318.10
IUPAC Name2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride
SMILESCc1cccc2nc(CNC(=O)C(C)(C)N)cn12.Cl.Cl
InChIInChI=1S/C13H18N4O.2ClH/c1-9-5-4-6-11-16-10(8-17(9)11)7-15-12(18)13(2,3)14;;/h4-6,8H,7,14H2,1-3H3,(H,15,18);2*1H
InChIKeyBSIACVIHBIUBMB-UHFFFAOYSA-N
XLogP1.84
TPSA72.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.24
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride?
The IUPAC name of 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride (CID 119882818) is 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride is Cc1cccc2nc(CNC(=O)C(C)(C)N)cn12.Cl.Cl.
What is the InChIKey of 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride?
The InChIKey is BSIACVIHBIUBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O.2ClH/c1-9-5-4-6-11-16-10(8-17(9)11)7-15-12(18)13(2,3)14;;/h4-6,8H,7,14H2,1-3H3,(H,15,18);2*1H.
What are the key properties of 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride?
2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride has a molecular weight of 319.24 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride is sourced from PubChem (CID 119882818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).