pyrrolo[1,2-a]pyrimidin-7-amine

C7H7N3 — CID 55285074

IUPACpyrrolo[1,2-a]pyrimidin-7-amine
SMILESNc1cc2ncccn2c1
InChIInChI=1S/C7H7N3/c8-6-4-7-9-2-1-3-10(7)5-6/h1-5H,8H2
InChIKeyQTAYIMGPWVBIEN-UHFFFAOYSA-N
MW133.15 g/mol
LogP0.92
Rot. Bonds

About pyrrolo[1,2-a]pyrimidin-7-amine

pyrrolo[1,2-a]pyrimidin-7-amine (PubChem CID 55285074) has the molecular formula C7H7N3 and a molecular weight of 133.15 g/mol. Its IUPAC name is pyrrolo[1,2-a]pyrimidin-7-amine.

Molecular Properties

Compound Namepyrrolo[1,2-a]pyrimidin-7-amine
PubChem CID55285074
Molecular FormulaC7H7N3
Molecular Weight133.15 g/mol
Exact Mass133.06
IUPAC Namepyrrolo[1,2-a]pyrimidin-7-amine
SMILESNc1cc2ncccn2c1
InChIInChI=1S/C7H7N3/c8-6-4-7-9-2-1-3-10(7)5-6/h1-5H,8H2
InChIKeyQTAYIMGPWVBIEN-UHFFFAOYSA-N
XLogP0.92
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyrrolo[1,2-a]pyrimidin-7-amine?
The IUPAC name of pyrrolo[1,2-a]pyrimidin-7-amine (CID 55285074) is pyrrolo[1,2-a]pyrimidin-7-amine.
What is the SMILES notation for pyrrolo[1,2-a]pyrimidin-7-amine?
The canonical SMILES for pyrrolo[1,2-a]pyrimidin-7-amine is Nc1cc2ncccn2c1.
What is the InChIKey of pyrrolo[1,2-a]pyrimidin-7-amine?
The InChIKey is QTAYIMGPWVBIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3/c8-6-4-7-9-2-1-3-10(7)5-6/h1-5H,8H2.
What are the key properties of pyrrolo[1,2-a]pyrimidin-7-amine?
pyrrolo[1,2-a]pyrimidin-7-amine has a molecular weight of 133.15 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolo[1,2-a]pyrimidin-7-amine is sourced from PubChem (CID 55285074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).