1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea

C13H13N5O2 — CID 159899663

IUPAC1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea
SMILESCNC(=O)Nc1cn2cc(C)nc2c(-c2ccco2)n1
InChIInChI=1S/C13H13N5O2/c1-8-6-18-7-10(17-13(19)14-2)16-11(12(18)15-8)9-4-3-5-20-9/h3-7H,1-2H3,(H2,14,17,19)
InChIKeyHEOFXMMPQDLRTF-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.05
Rot. Bonds2

About 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea

1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea (PubChem CID 159899663) has the molecular formula C13H13N5O2 and a molecular weight of 271.28 g/mol. Its IUPAC name is 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea.

Molecular Properties

Compound Name1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea
PubChem CID159899663
Molecular FormulaC13H13N5O2
Molecular Weight271.28 g/mol
Exact Mass271.11
IUPAC Name1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea
SMILESCNC(=O)Nc1cn2cc(C)nc2c(-c2ccco2)n1
InChIInChI=1S/C13H13N5O2/c1-8-6-18-7-10(17-13(19)14-2)16-11(12(18)15-8)9-4-3-5-20-9/h3-7H,1-2H3,(H2,14,17,19)
InChIKeyHEOFXMMPQDLRTF-UHFFFAOYSA-N
XLogP2.05
TPSA84.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea?
The IUPAC name of 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea (CID 159899663) is 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea.
What is the SMILES notation for 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea?
The canonical SMILES for 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea is CNC(=O)Nc1cn2cc(C)nc2c(-c2ccco2)n1.
What is the InChIKey of 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea?
The InChIKey is HEOFXMMPQDLRTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O2/c1-8-6-18-7-10(17-13(19)14-2)16-11(12(18)15-8)9-4-3-5-20-9/h3-7H,1-2H3,(H2,14,17,19).
What are the key properties of 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea?
1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea has a molecular weight of 271.28 g/mol, XLogP of 2.05, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-(furan-2-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]-3-methylurea is sourced from PubChem (CID 159899663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).