5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine

C7H8FN3 — CID 145143537

IUPAC5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
SMILESCC1=NCNc2[nH]cc(F)c21
InChIInChI=1S/C7H8FN3/c1-4-6-5(8)2-9-7(6)11-3-10-4/h2,9,11H,3H2,1H3
InChIKeyGQCKNRCSAHFVSZ-UHFFFAOYSA-N
MW153.16 g/mol
LogP1.35
Rot. Bonds

About 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine

5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine (PubChem CID 145143537) has the molecular formula C7H8FN3 and a molecular weight of 153.16 g/mol. Its IUPAC name is 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine.

Molecular Properties

Compound Name5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
PubChem CID145143537
Molecular FormulaC7H8FN3
Molecular Weight153.16 g/mol
Exact Mass153.07
IUPAC Name5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine
SMILESCC1=NCNc2[nH]cc(F)c21
InChIInChI=1S/C7H8FN3/c1-4-6-5(8)2-9-7(6)11-3-10-4/h2,9,11H,3H2,1H3
InChIKeyGQCKNRCSAHFVSZ-UHFFFAOYSA-N
XLogP1.35
TPSA40.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.16
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine 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-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The IUPAC name of 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine (CID 145143537) is 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine.
What is the SMILES notation for 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The canonical SMILES for 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine is CC1=NCNc2[nH]cc(F)c21.
What is the InChIKey of 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
The InChIKey is GQCKNRCSAHFVSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN3/c1-4-6-5(8)2-9-7(6)11-3-10-4/h2,9,11H,3H2,1H3.
What are the key properties of 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine?
5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine has a molecular weight of 153.16 g/mol, XLogP of 1.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methyl-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine is sourced from PubChem (CID 145143537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).