[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone

C17H17N5O2 — CID 110117503

IUPAC[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone
SMILESCOc1cccc(C2Cn3ccnc3CN2C(=O)c2ccn[nH]2)c1
InChIInChI=1S/C17H17N5O2/c1-24-13-4-2-3-12(9-13)15-10-21-8-7-18-16(21)11-22(15)17(23)14-5-6-19-20-14/h2-9,15H,10-11H2,1H3,(H,19,20)
InChIKeyGLUGHMFNADPXHE-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.01
Rot. Bonds3

About [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone

[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone (PubChem CID 110117503) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone.

Molecular Properties

Compound Name[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone
PubChem CID110117503
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone
SMILESCOc1cccc(C2Cn3ccnc3CN2C(=O)c2ccn[nH]2)c1
InChIInChI=1S/C17H17N5O2/c1-24-13-4-2-3-12(9-13)15-10-21-8-7-18-16(21)11-22(15)17(23)14-5-6-19-20-14/h2-9,15H,10-11H2,1H3,(H,19,20)
InChIKeyGLUGHMFNADPXHE-UHFFFAOYSA-N
XLogP2.01
TPSA76.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(6R)-6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-thiophen-2-ylmethanone
CID 124987765
(6S)-6-(3-methoxyphenyl)-7-methylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 124971840
2-methoxy-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
CID 124973448
[(6R)-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(2-methylpyrimidin-4-yl)methanone
CID 124958136
[(6R)-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,3-oxazol-5-yl)methanone
CID 124967063
N-[2-[[2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]amino]ethyl]-1H-pyrazole-5-carboxamide
CID 166205678
[(2R)-2-(3-methoxyphenyl)azetidin-1-yl]-[4-(1H-pyrazol-5-yl)phenyl]methanone
CID 97454861
(3-ethyl-1,2-oxazol-5-yl)-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 124962333
(2,4-dimethyl-1,3-thiazol-5-yl)-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 124992459
3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
CID 125015168
(5-methyl-1,3-oxazol-4-yl)-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 124967482
(1-ethyl-3-methylpyrazol-4-yl)-(6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 110117625

Frequently Asked Questions

What is the IUPAC name of [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone?
The IUPAC name of [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone (CID 110117503) is [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone.
What is the SMILES notation for [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone?
The canonical SMILES for [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone is COc1cccc(C2Cn3ccnc3CN2C(=O)c2ccn[nH]2)c1.
What is the InChIKey of [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone?
The InChIKey is GLUGHMFNADPXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-24-13-4-2-3-12(9-13)15-10-21-8-7-18-16(21)11-22(15)17(23)14-5-6-19-20-14/h2-9,15H,10-11H2,1H3,(H,19,20).
What are the key properties of [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone?
[6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone has a molecular weight of 323.36 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1H-pyrazol-5-yl)methanone is sourced from PubChem (CID 110117503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).