imidazo[1,2-a]pyrimidine-6-carbonitrile

C7H4N4 — CID 55266910

IUPACimidazo[1,2-a]pyrimidine-6-carbonitrile
SMILESN#Cc1cnc2nccn2c1
InChIInChI=1S/C7H4N4/c8-3-6-4-10-7-9-1-2-11(7)5-6/h1-2,4-5H
InChIKeyLSUUUIRODBRUQR-UHFFFAOYSA-N
MW144.14 g/mol
LogP0.60
Rot. Bonds

About imidazo[1,2-a]pyrimidine-6-carbonitrile

imidazo[1,2-a]pyrimidine-6-carbonitrile (PubChem CID 55266910) has the molecular formula C7H4N4 and a molecular weight of 144.14 g/mol. Its IUPAC name is imidazo[1,2-a]pyrimidine-6-carbonitrile.

Molecular Properties

Compound Nameimidazo[1,2-a]pyrimidine-6-carbonitrile
PubChem CID55266910
Molecular FormulaC7H4N4
Molecular Weight144.14 g/mol
Exact Mass144.04
IUPAC Nameimidazo[1,2-a]pyrimidine-6-carbonitrile
SMILESN#Cc1cnc2nccn2c1
InChIInChI=1S/C7H4N4/c8-3-6-4-10-7-9-1-2-11(7)5-6/h1-2,4-5H
InChIKeyLSUUUIRODBRUQR-UHFFFAOYSA-N
XLogP0.60
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.14
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyrimidine-6-carbonitrile?
The IUPAC name of imidazo[1,2-a]pyrimidine-6-carbonitrile (CID 55266910) is imidazo[1,2-a]pyrimidine-6-carbonitrile.
What is the SMILES notation for imidazo[1,2-a]pyrimidine-6-carbonitrile?
The canonical SMILES for imidazo[1,2-a]pyrimidine-6-carbonitrile is N#Cc1cnc2nccn2c1.
What is the InChIKey of imidazo[1,2-a]pyrimidine-6-carbonitrile?
The InChIKey is LSUUUIRODBRUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4N4/c8-3-6-4-10-7-9-1-2-11(7)5-6/h1-2,4-5H.
What are the key properties of imidazo[1,2-a]pyrimidine-6-carbonitrile?
imidazo[1,2-a]pyrimidine-6-carbonitrile has a molecular weight of 144.14 g/mol, XLogP of 0.60, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyrimidine-6-carbonitrile is sourced from PubChem (CID 55266910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).