(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone

C17H22N4O3 — CID 97467436

IUPAC(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
SMILESCc1ccoc1C(=O)N1CCn2cc(CN3CCOCC3)nc2C1
InChIInChI=1S/C17H22N4O3/c1-13-2-7-24-16(13)17(22)21-4-3-20-11-14(18-15(20)12-21)10-19-5-8-23-9-6-19/h2,7,11H,3-6,8-10,12H2,1H3
InChIKeyHRUPXKUEJUYMOB-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.27
Rot. Bonds3

About (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone

(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone (PubChem CID 97467436) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone.

Molecular Properties

Compound Name(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
PubChem CID97467436
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
SMILESCc1ccoc1C(=O)N1CCn2cc(CN3CCOCC3)nc2C1
InChIInChI=1S/C17H22N4O3/c1-13-2-7-24-16(13)17(22)21-4-3-20-11-14(18-15(20)12-21)10-19-5-8-23-9-6-19/h2,7,11H,3-6,8-10,12H2,1H3
InChIKeyHRUPXKUEJUYMOB-UHFFFAOYSA-N
XLogP1.27
TPSA63.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone?
The IUPAC name of (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone (CID 97467436) is (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone.
What is the SMILES notation for (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone?
The canonical SMILES for (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone is Cc1ccoc1C(=O)N1CCn2cc(CN3CCOCC3)nc2C1.
What is the InChIKey of (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone?
The InChIKey is HRUPXKUEJUYMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-13-2-7-24-16(13)17(22)21-4-3-20-11-14(18-15(20)12-21)10-19-5-8-23-9-6-19/h2,7,11H,3-6,8-10,12H2,1H3.
What are the key properties of (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone?
(3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone has a molecular weight of 330.39 g/mol, XLogP of 1.27, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylfuran-2-yl)-[2-(morpholin-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone is sourced from PubChem (CID 97467436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).