[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine

C15H20N4 — CID 136995684

IUPAC[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCCc1ccc(-c2nc3n(c2CN)CCCN3)cc1
InChIInChI=1S/C15H20N4/c1-2-11-4-6-12(7-5-11)14-13(10-16)19-9-3-8-17-15(19)18-14/h4-7H,2-3,8-10,16H2,1H3,(H,17,18)
InChIKeySVINGNDZZGLLGN-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.39
Rot. Bonds3

About [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine

[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine (PubChem CID 136995684) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine
PubChem CID136995684
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCCc1ccc(-c2nc3n(c2CN)CCCN3)cc1
InChIInChI=1S/C15H20N4/c1-2-11-4-6-12(7-5-11)14-13(10-16)19-9-3-8-17-15(19)18-14/h4-7H,2-3,8-10,16H2,1H3,(H,17,18)
InChIKeySVINGNDZZGLLGN-UHFFFAOYSA-N
XLogP2.39
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine?
The IUPAC name of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine (CID 136995684) is [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine.
What is the SMILES notation for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine?
The canonical SMILES for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine is CCc1ccc(-c2nc3n(c2CN)CCCN3)cc1.
What is the InChIKey of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine?
The InChIKey is SVINGNDZZGLLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-11-4-6-12(7-5-11)14-13(10-16)19-9-3-8-17-15(19)18-14/h4-7H,2-3,8-10,16H2,1H3,(H,17,18).
What are the key properties of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine?
[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine has a molecular weight of 256.35 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine is sourced from PubChem (CID 136995684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).