2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone

C19H30N4O3 — CID 124910747

IUPAC2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
SMILESC[C@@H]1c2nc(CC(=O)N3CCOCC3)cn2CCN1CC1CCOCC1
InChIInChI=1S/C19H30N4O3/c1-15-19-20-17(12-18(24)21-6-10-26-11-7-21)14-23(19)5-4-22(15)13-16-2-8-25-9-3-16/h14-16H,2-13H2,1H3/t15-/m1/s1
InChIKeyZJUMNOGWCJBUSP-OAHLLOKOSA-N
MW362.47 g/mol
LogP1.09
Rot. Bonds4

About 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone

2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone (PubChem CID 124910747) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
PubChem CID124910747
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC Name2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
SMILESC[C@@H]1c2nc(CC(=O)N3CCOCC3)cn2CCN1CC1CCOCC1
InChIInChI=1S/C19H30N4O3/c1-15-19-20-17(12-18(24)21-6-10-26-11-7-21)14-23(19)5-4-22(15)13-16-2-8-25-9-3-16/h14-16H,2-13H2,1H3/t15-/m1/s1
InChIKeyZJUMNOGWCJBUSP-OAHLLOKOSA-N
XLogP1.09
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone (CID 124910747) is 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone is C[C@@H]1c2nc(CC(=O)N3CCOCC3)cn2CCN1CC1CCOCC1.
What is the InChIKey of 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The InChIKey is ZJUMNOGWCJBUSP-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-15-19-20-17(12-18(24)21-6-10-26-11-7-21)14-23(19)5-4-22(15)13-16-2-8-25-9-3-16/h14-16H,2-13H2,1H3/t15-/m1/s1.
What are the key properties of 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone has a molecular weight of 362.47 g/mol, XLogP of 1.09, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8R)-8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 124910747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).