5-methylpyrrolo[3,2-d]pyrimidin-4-amine

C7H8N4 — CID 140546052

IUPAC5-methylpyrrolo[3,2-d]pyrimidin-4-amine
SMILESCn1ccc2ncnc(N)c21
InChIInChI=1S/C7H8N4/c1-11-3-2-5-6(11)7(8)10-4-9-5/h2-4H,1H3,(H2,8,9,10)
InChIKeyCIKMEWMNJULNFB-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.55
Rot. Bonds

About 5-methylpyrrolo[3,2-d]pyrimidin-4-amine

5-methylpyrrolo[3,2-d]pyrimidin-4-amine (PubChem CID 140546052) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 5-methylpyrrolo[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5-methylpyrrolo[3,2-d]pyrimidin-4-amine
PubChem CID140546052
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name5-methylpyrrolo[3,2-d]pyrimidin-4-amine
SMILESCn1ccc2ncnc(N)c21
InChIInChI=1S/C7H8N4/c1-11-3-2-5-6(11)7(8)10-4-9-5/h2-4H,1H3,(H2,8,9,10)
InChIKeyCIKMEWMNJULNFB-UHFFFAOYSA-N
XLogP0.55
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methylpyrrolo[3,2-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methylpyrrolo[3,2-d]pyrimidin-4-amine?
The IUPAC name of 5-methylpyrrolo[3,2-d]pyrimidin-4-amine (CID 140546052) is 5-methylpyrrolo[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 5-methylpyrrolo[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 5-methylpyrrolo[3,2-d]pyrimidin-4-amine is Cn1ccc2ncnc(N)c21.
What is the InChIKey of 5-methylpyrrolo[3,2-d]pyrimidin-4-amine?
The InChIKey is CIKMEWMNJULNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-11-3-2-5-6(11)7(8)10-4-9-5/h2-4H,1H3,(H2,8,9,10).
What are the key properties of 5-methylpyrrolo[3,2-d]pyrimidin-4-amine?
5-methylpyrrolo[3,2-d]pyrimidin-4-amine has a molecular weight of 148.17 g/mol, XLogP of 0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylpyrrolo[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 140546052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).