N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride

C15H22Cl2N4OS — CID 119942098

IUPACN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
SMILESCc1cccc2nc(CNC(=O)CC3CSCCN3)cn12.Cl.Cl
InChIInChI=1S/C15H20N4OS.2ClH/c1-11-3-2-4-14-18-13(9-19(11)14)8-17-15(20)7-12-10-21-6-5-16-12;;/h2-4,9,12,16H,5-8,10H2,1H3,(H,17,20);2*1H
InChIKeyBBMAUYGENDNECG-UHFFFAOYSA-N
MW377.34 g/mol
LogP2.20
Rot. Bonds4

About N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride

N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride (PubChem CID 119942098) has the molecular formula C15H22Cl2N4OS and a molecular weight of 377.34 g/mol. Its IUPAC name is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride.

Molecular Properties

Compound NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
PubChem CID119942098
Molecular FormulaC15H22Cl2N4OS
Molecular Weight377.34 g/mol
Exact Mass376.09
IUPAC NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
SMILESCc1cccc2nc(CNC(=O)CC3CSCCN3)cn12.Cl.Cl
InChIInChI=1S/C15H20N4OS.2ClH/c1-11-3-2-4-14-18-13(9-19(11)14)8-17-15(20)7-12-10-21-6-5-16-12;;/h2-4,9,12,16H,5-8,10H2,1H3,(H,17,20);2*1H
InChIKeyBBMAUYGENDNECG-UHFFFAOYSA-N
XLogP2.20
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.34
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methylpyrimidin-4-yl)methyl]-2-thiomorpholin-3-ylacetamide
CID 66422864
N-[(4-methylphenyl)methyl]-2-thiomorpholin-3-ylacetamide
CID 66422601
2-(methylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 83626352
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119882850
N-[2-(2,6-dimethylphenoxy)ethyl]-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119937188
2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride
CID 119882864
N-[[3-(methoxymethyl)phenyl]methyl]-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119936585
N-(pyrimidin-4-ylmethyl)-2-thiomorpholin-3-ylacetamide
CID 114110925
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(5-methylthiophen-2-yl)acetamide
CID 56785456
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-3-carboxamide
CID 119882870
N-[2-(3-methylphenyl)ethyl]-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119937610
N-[(3-methyl-4-pyridinyl)methyl]-2-thiomorpholin-3-ylacetamide
CID 114700218

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride?
The IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride (CID 119942098) is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride.
What is the SMILES notation for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride?
The canonical SMILES for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride is Cc1cccc2nc(CNC(=O)CC3CSCCN3)cn12.Cl.Cl.
What is the InChIKey of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride?
The InChIKey is BBMAUYGENDNECG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS.2ClH/c1-11-3-2-4-14-18-13(9-19(11)14)8-17-15(20)7-12-10-21-6-5-16-12;;/h2-4,9,12,16H,5-8,10H2,1H3,(H,17,20);2*1H.
What are the key properties of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride?
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride has a molecular weight of 377.34 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride is sourced from PubChem (CID 119942098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).