1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine

C10H13N5 — CID 62846264

IUPAC1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine
SMILESCc1cnc(CNCc2cnc[nH]2)cn1
InChIInChI=1S/C10H13N5/c1-8-2-14-10(6-13-8)4-11-3-9-5-12-7-15-9/h2,5-7,11H,3-4H2,1H3,(H,12,15)
InChIKeyYKIQLXMTOFYMKR-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.80
Rot. Bonds4

About 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine

1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine (PubChem CID 62846264) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine
PubChem CID62846264
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine
SMILESCc1cnc(CNCc2cnc[nH]2)cn1
InChIInChI=1S/C10H13N5/c1-8-2-14-10(6-13-8)4-11-3-9-5-12-7-15-9/h2,5-7,11H,3-4H2,1H3,(H,12,15)
InChIKeyYKIQLXMTOFYMKR-UHFFFAOYSA-N
XLogP0.80
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine?
The IUPAC name of 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine (CID 62846264) is 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine.
What is the SMILES notation for 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine?
The canonical SMILES for 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine is Cc1cnc(CNCc2cnc[nH]2)cn1.
What is the InChIKey of 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine?
The InChIKey is YKIQLXMTOFYMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-8-2-14-10(6-13-8)4-11-3-9-5-12-7-15-9/h2,5-7,11H,3-4H2,1H3,(H,12,15).
What are the key properties of 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine?
1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine has a molecular weight of 203.25 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-5-yl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine is sourced from PubChem (CID 62846264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).