3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile

C7H5N5 — CID 82415698

IUPAC3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile
SMILESN#Cc1cnc2ncc(N)n2c1
InChIInChI=1S/C7H5N5/c8-1-5-2-10-7-11-3-6(9)12(7)4-5/h2-4H,9H2
InChIKeyKVUUYZMYEBBZJA-UHFFFAOYSA-N
MW159.15 g/mol
LogP0.18
Rot. Bonds

About 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile

3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile (PubChem CID 82415698) has the molecular formula C7H5N5 and a molecular weight of 159.15 g/mol. Its IUPAC name is 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile.

Molecular Properties

Compound Name3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile
PubChem CID82415698
Molecular FormulaC7H5N5
Molecular Weight159.15 g/mol
Exact Mass159.05
IUPAC Name3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile
SMILESN#Cc1cnc2ncc(N)n2c1
InChIInChI=1S/C7H5N5/c8-1-5-2-10-7-11-3-6(9)12(7)4-5/h2-4H,9H2
InChIKeyKVUUYZMYEBBZJA-UHFFFAOYSA-N
XLogP0.18
TPSA80.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.15
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-aminoimidazo[1,2-a]pyrimidin-6-yl)benzonitrile
CID 82389497
pyrimido[1,2-a]benzimidazole-3-carbonitrile
CID 82401393
2-(aminomethyl)imidazo[1,2-a]pyrimidine-6-carbonitrile
CID 55266924
triazolo[1,5-a]pyrimidine-6-carbonitrile
CID 89258279
3-amino-5-methylimidazo[1,2-a]pyridine-7-carbonitrile
CID 130065390
3-aminoimidazo[1,2-a]pyridine-7,8-dicarbonitrile
CID 130065666
2-prop-1-ynylpyrimidine-5-carbonitrile
CID 126693035
6-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 82381264
3-formylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
CID 105435034
1-(2-aminophenyl)pyrazole-4-carbonitrile
CID 84769361
2-methyl-3-propylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
CID 169223310
1-(2-aminoethyl)pyrazole-4-carbonitrile;hydrochloride
CID 146048593

Frequently Asked Questions

What is the IUPAC name of 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile?
The IUPAC name of 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile (CID 82415698) is 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile.
What is the SMILES notation for 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile?
The canonical SMILES for 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile is N#Cc1cnc2ncc(N)n2c1.
What is the InChIKey of 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile?
The InChIKey is KVUUYZMYEBBZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N5/c8-1-5-2-10-7-11-3-6(9)12(7)4-5/h2-4H,9H2.
What are the key properties of 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile?
3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile has a molecular weight of 159.15 g/mol, XLogP of 0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminoimidazo[1,2-a]pyrimidine-6-carbonitrile is sourced from PubChem (CID 82415698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).