[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone

C13H17N5O2 — CID 97390254

IUPAC[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone
SMILESCN(C)Cc1cn2c(n1)CN(C(=O)c1ccno1)CC2
InChIInChI=1S/C13H17N5O2/c1-16(2)7-10-8-17-5-6-18(9-12(17)15-10)13(19)11-3-4-14-20-11/h3-4,8H,5-7,9H2,1-2H3
InChIKeyICXNMJFCTGUOIT-UHFFFAOYSA-N
MW275.31 g/mol
LogP0.59
Rot. Bonds3

About [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone

[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone (PubChem CID 97390254) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone.

Molecular Properties

Compound Name[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone
PubChem CID97390254
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone
SMILESCN(C)Cc1cn2c(n1)CN(C(=O)c1ccno1)CC2
InChIInChI=1S/C13H17N5O2/c1-16(2)7-10-8-17-5-6-18(9-12(17)15-10)13(19)11-3-4-14-20-11/h3-4,8H,5-7,9H2,1-2H3
InChIKeyICXNMJFCTGUOIT-UHFFFAOYSA-N
XLogP0.59
TPSA67.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone?
The IUPAC name of [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone (CID 97390254) is [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone.
What is the SMILES notation for [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone?
The canonical SMILES for [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone is CN(C)Cc1cn2c(n1)CN(C(=O)c1ccno1)CC2.
What is the InChIKey of [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone?
The InChIKey is ICXNMJFCTGUOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-16(2)7-10-8-17-5-6-18(9-12(17)15-10)13(19)11-3-4-14-20-11/h3-4,8H,5-7,9H2,1-2H3.
What are the key properties of [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone?
[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone has a molecular weight of 275.31 g/mol, XLogP of 0.59, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1,2-oxazol-5-yl)methanone is sourced from PubChem (CID 97390254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).