5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine

C7H9N3 — CID 130241257

IUPAC5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
SMILESCc1c[nH]c2c1C=NCN2
InChIInChI=1S/C7H9N3/c1-5-2-9-7-6(5)3-8-4-10-7/h2-3,9-10H,4H2,1H3
InChIKeyDFBNOAZEBZAOST-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.13
Rot. Bonds

About 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine

5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine (PubChem CID 130241257) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine.

Molecular Properties

Compound Name5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
PubChem CID130241257
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
SMILESCc1c[nH]c2c1C=NCN2
InChIInChI=1S/C7H9N3/c1-5-2-9-7-6(5)3-8-4-10-7/h2-3,9-10H,4H2,1H3
InChIKeyDFBNOAZEBZAOST-UHFFFAOYSA-N
XLogP1.13
TPSA40.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The IUPAC name of 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine (CID 130241257) is 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine.
What is the SMILES notation for 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The canonical SMILES for 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine is Cc1c[nH]c2c1C=NCN2.
What is the InChIKey of 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The InChIKey is DFBNOAZEBZAOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-5-2-9-7-6(5)3-8-4-10-7/h2-3,9-10H,4H2,1H3.
What are the key properties of 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine has a molecular weight of 135.17 g/mol, XLogP of 1.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine is sourced from PubChem (CID 130241257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).