6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine

C12H16N6O — CID 134069749

IUPAC6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine
SMILESCOc1cc(NCc2cn3c(n2)CNCC3)ncn1
InChIInChI=1S/C12H16N6O/c1-19-12-4-10(15-8-16-12)14-5-9-7-18-3-2-13-6-11(18)17-9/h4,7-8,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyIXIHDOGZTADEBG-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.40
Rot. Bonds4

About 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine

6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine (PubChem CID 134069749) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine
PubChem CID134069749
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC Name6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine
SMILESCOc1cc(NCc2cn3c(n2)CNCC3)ncn1
InChIInChI=1S/C12H16N6O/c1-19-12-4-10(15-8-16-12)14-5-9-7-18-3-2-13-6-11(18)17-9/h4,7-8,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyIXIHDOGZTADEBG-UHFFFAOYSA-N
XLogP0.40
TPSA76.89 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine (CID 134069749) is 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine is COc1cc(NCc2cn3c(n2)CNCC3)ncn1.
What is the InChIKey of 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is IXIHDOGZTADEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-19-12-4-10(15-8-16-12)14-5-9-7-18-3-2-13-6-11(18)17-9/h4,7-8,13H,2-3,5-6H2,1H3,(H,14,15,16).
What are the key properties of 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine?
6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 260.30 g/mol, XLogP of 0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 134069749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).