2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine

C15H22N4OS — CID 63059993

IUPAC2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
SMILESCOCCNCc1c(N2CCSCC2)nc2ccccn12
InChIInChI=1S/C15H22N4OS/c1-20-9-5-16-12-13-15(18-7-10-21-11-8-18)17-14-4-2-3-6-19(13)14/h2-4,6,16H,5,7-12H2,1H3
InChIKeyPRLGVNFEECSJHE-UHFFFAOYSA-N
MW306.44 g/mol
LogP1.62
Rot. Bonds6

About 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine

2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine (PubChem CID 63059993) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
PubChem CID63059993
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
SMILESCOCCNCc1c(N2CCSCC2)nc2ccccn12
InChIInChI=1S/C15H22N4OS/c1-20-9-5-16-12-13-15(18-7-10-21-11-8-18)17-14-4-2-3-6-19(13)14/h2-4,6,16H,5,7-12H2,1H3
InChIKeyPRLGVNFEECSJHE-UHFFFAOYSA-N
XLogP1.62
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[2-(1,4-thiazepan-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]ethanamine
CID 61419303
N-methyl-1-[2-(1,4-thiazepan-4-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 61419254
N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]cyclopropanamine
CID 43478365
N-[[2-(4-chloropyrazol-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]-2-methoxyethanamine
CID 63070945
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-thiomorpholin-4-ylethanamine
CID 103745424
N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
CID 103535779
2-methoxy-N-[(6-piperidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63059091
2-methoxy-N-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methyl]ethanamine
CID 63805231
3-[3-[(2-methoxyethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]sulfanylpropane-1,2-diol
CID 79671023
3-(2-methoxyethoxy)-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
CID 43770876
3-[3-[(2-methoxyethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]sulfanylbutan-1-ol
CID 66136871
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 103499447

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine (CID 63059993) is 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine is COCCNCc1c(N2CCSCC2)nc2ccccn12.
What is the InChIKey of 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine?
The InChIKey is PRLGVNFEECSJHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-20-9-5-16-12-13-15(18-7-10-21-11-8-18)17-14-4-2-3-6-19(13)14/h2-4,6,16H,5,7-12H2,1H3.
What are the key properties of 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine?
2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine has a molecular weight of 306.44 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine is sourced from PubChem (CID 63059993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).