3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine

C13H19N5OS — CID 99857818

IUPAC3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine
SMILESCOCCc1nsc(N[C@H]2CCc3nc(C)cn3C2)n1
InChIInChI=1S/C13H19N5OS/c1-9-7-18-8-10(3-4-12(18)14-9)15-13-16-11(17-20-13)5-6-19-2/h7,10H,3-6,8H2,1-2H3,(H,15,16,17)/t10-/m0/s1
InChIKeyHMYMMMNRVFGDLF-JTQLQIEISA-N
MW293.40 g/mol
LogP1.66
Rot. Bonds5

About 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine

3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine (PubChem CID 99857818) has the molecular formula C13H19N5OS and a molecular weight of 293.40 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine
PubChem CID99857818
Molecular FormulaC13H19N5OS
Molecular Weight293.40 g/mol
Exact Mass293.13
IUPAC Name3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine
SMILESCOCCc1nsc(N[C@H]2CCc3nc(C)cn3C2)n1
InChIInChI=1S/C13H19N5OS/c1-9-7-18-8-10(3-4-12(18)14-9)15-13-16-11(17-20-13)5-6-19-2/h7,10H,3-6,8H2,1-2H3,(H,15,16,17)/t10-/m0/s1
InChIKeyHMYMMMNRVFGDLF-JTQLQIEISA-N
XLogP1.66
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-(2-methoxyethyl)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine
CID 99857817
(2R)-2-(2-methoxyethoxy)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95769272
cyclopentyl-[3-[[3-(2-methoxyethyl)-1,2,4-thiadiazol-5-yl]amino]pyrrolidin-1-yl]methanone
CID 133366768
2-methyl-N-pentan-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 115715531
(2S)-2-methoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765991
methyl N-[2-[3-[[3-(2-methoxyethyl)-1,2,4-thiadiazol-5-yl]amino]azocan-1-yl]-2-oxoethyl]carbamate
CID 138007596
2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
CID 95136799
(2S)-2-ethoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765907
methyl 2-methyl-5-[[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]methyl]furan-3-carboxylate
CID 75497517
2-(2-ethyl-1,3-thiazol-4-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765998
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-thiophen-2-ylacetamide
CID 86772548
3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
CID 133383314

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine (CID 99857818) is 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine is COCCc1nsc(N[C@H]2CCc3nc(C)cn3C2)n1.
What is the InChIKey of 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine?
The InChIKey is HMYMMMNRVFGDLF-JTQLQIEISA-N. The full InChI is InChI=1S/C13H19N5OS/c1-9-7-18-8-10(3-4-12(18)14-9)15-13-16-11(17-20-13)5-6-19-2/h7,10H,3-6,8H2,1-2H3,(H,15,16,17)/t10-/m0/s1.
What are the key properties of 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine?
3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine has a molecular weight of 293.40 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 99857818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).