6-amino-2-methylpyrimidine-4-carboximidamide

C6H9N5 — CID 130647809

IUPAC6-amino-2-methylpyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(N)nc(C)n1
InChIInChI=1S/C6H9N5/c1-3-10-4(6(8)9)2-5(7)11-3/h2H,1H3,(H3,8,9)(H2,7,10,11)
InChIKeyPZEYYWQZVGSTQA-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.35
Rot. Bonds1

About 6-amino-2-methylpyrimidine-4-carboximidamide

6-amino-2-methylpyrimidine-4-carboximidamide (PubChem CID 130647809) has the molecular formula C6H9N5 and a molecular weight of 151.17 g/mol. Its IUPAC name is 6-amino-2-methylpyrimidine-4-carboximidamide.

Molecular Properties

Compound Name6-amino-2-methylpyrimidine-4-carboximidamide
PubChem CID130647809
Molecular FormulaC6H9N5
Molecular Weight151.17 g/mol
Exact Mass151.09
IUPAC Name6-amino-2-methylpyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(N)nc(C)n1
InChIInChI=1S/C6H9N5/c1-3-10-4(6(8)9)2-5(7)11-3/h2H,1H3,(H3,8,9)(H2,7,10,11)
InChIKeyPZEYYWQZVGSTQA-UHFFFAOYSA-N
XLogP-0.35
TPSA101.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methylpyrimidine-4-carboximidamide?
The IUPAC name of 6-amino-2-methylpyrimidine-4-carboximidamide (CID 130647809) is 6-amino-2-methylpyrimidine-4-carboximidamide.
What is the SMILES notation for 6-amino-2-methylpyrimidine-4-carboximidamide?
The canonical SMILES for 6-amino-2-methylpyrimidine-4-carboximidamide is [H]/N=C(\N)c1cc(N)nc(C)n1.
What is the InChIKey of 6-amino-2-methylpyrimidine-4-carboximidamide?
The InChIKey is PZEYYWQZVGSTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N5/c1-3-10-4(6(8)9)2-5(7)11-3/h2H,1H3,(H3,8,9)(H2,7,10,11).
What are the key properties of 6-amino-2-methylpyrimidine-4-carboximidamide?
6-amino-2-methylpyrimidine-4-carboximidamide has a molecular weight of 151.17 g/mol, XLogP of -0.35, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methylpyrimidine-4-carboximidamide is sourced from PubChem (CID 130647809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).