[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone

C17H16FN5O2S — CID 124810586

IUPAC[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
SMILESCc1nc(C(=O)N2Cc3cncn3[C@H](COc3ncccc3F)C2)cs1
InChIInChI=1S/C17H16FN5O2S/c1-11-21-15(9-26-11)17(24)22-6-12-5-19-10-23(12)13(7-22)8-25-16-14(18)3-2-4-20-16/h2-5,9-10,13H,6-8H2,1H3/t13-/m0/s1
InChIKeyOZUCRKBWIHEBQV-ZDUSSCGKSA-N
MW373.41 g/mol
LogP2.46
Rot. Bonds4

About [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone

[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone (PubChem CID 124810586) has the molecular formula C17H16FN5O2S and a molecular weight of 373.41 g/mol. Its IUPAC name is [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone.

Molecular Properties

Compound Name[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
PubChem CID124810586
Molecular FormulaC17H16FN5O2S
Molecular Weight373.41 g/mol
Exact Mass373.10
IUPAC Name[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
SMILESCc1nc(C(=O)N2Cc3cncn3[C@H](COc3ncccc3F)C2)cs1
InChIInChI=1S/C17H16FN5O2S/c1-11-21-15(9-26-11)17(24)22-6-12-5-19-10-23(12)13(7-22)8-25-16-14(18)3-2-4-20-16/h2-5,9-10,13H,6-8H2,1H3/t13-/m0/s1
InChIKeyOZUCRKBWIHEBQV-ZDUSSCGKSA-N
XLogP2.46
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(5R)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-2-thiophen-3-ylethanone
CID 124788233
(4-fluoro-2-methylphenyl)-[(5R)-5-(pyrimidin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
CID 124789315
(3-methylthiophen-2-yl)-[(5S)-5-(pyridin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
CID 124912265
(3-methylfuran-2-yl)-[5-(pyridin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
CID 131659969
(2-methyl-1,3-thiazol-4-yl)-[(7R)-7-(pyridin-3-ylmethoxy)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-5-yl]methanone
CID 124809043
2-(dimethylamino)-1-[(5S)-5-[(2-methyl-1,3-thiazol-4-yl)methoxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
CID 124812405
[6-[(3-fluoro-2-pyridinyl)oxymethyl]-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl]-(furan-3-yl)methanone
CID 133141690
(3-methylfuran-2-yl)-[(5S)-5-[(4-methylpyrimidin-2-yl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
CID 124893910
2-[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-4-yl]oxypyridine-3-carbonitrile
CID 72717266
2-methylsulfonyl-1-[5-(pyridin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
CID 133139399
1-benzothiophen-2-yl-[(5S)-5-(methoxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
CID 124795588
2-methylsulfonyl-1-[(5R)-5-(pyridin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
CID 124783000

Frequently Asked Questions

What is the IUPAC name of [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone?
The IUPAC name of [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone (CID 124810586) is [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone.
What is the SMILES notation for [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone?
The canonical SMILES for [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone is Cc1nc(C(=O)N2Cc3cncn3[C@H](COc3ncccc3F)C2)cs1.
What is the InChIKey of [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone?
The InChIKey is OZUCRKBWIHEBQV-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H16FN5O2S/c1-11-21-15(9-26-11)17(24)22-6-12-5-19-10-23(12)13(7-22)8-25-16-14(18)3-2-4-20-16/h2-5,9-10,13H,6-8H2,1H3/t13-/m0/s1.
What are the key properties of [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone?
[(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone has a molecular weight of 373.41 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(5S)-5-[(3-fluoro-2-pyridinyl)oxymethyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methyl-1,3-thiazol-4-yl)methanone is sourced from PubChem (CID 124810586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).