5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

C6H9N3 — CID 135625409

IUPAC5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
SMILESc1cn2c(n1)NCCC2
InChIInChI=1S/C6H9N3/c1-2-7-6-8-3-5-9(6)4-1/h3,5H,1-2,4H2,(H,7,8)
InChIKeyVCZBRPRKZKPDQD-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.70
Rot. Bonds

About 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (PubChem CID 135625409) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
PubChem CID135625409
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
SMILESc1cn2c(n1)NCCC2
InChIInChI=1S/C6H9N3/c1-2-7-6-8-3-5-9(6)4-1/h3,5H,1-2,4H2,(H,7,8)
InChIKeyVCZBRPRKZKPDQD-UHFFFAOYSA-N
XLogP0.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Imidazole-1-propanamine
CID 78736
4-(1H-imidazol-1-yl)butan-1-amine
CID 4379480
3-(2-methyl-1H-imidazol-1-yl)propan-1-amine
CID 3152105
5H,6H,7H,8H-imidazo[1,2-a]pyridine
CID 9989264
3-(1H-imidazol-1-yl)piperidine
CID 50986280
3-Imidazol-1-ylpropylcarbamodithioic acid
CID 3246650
potassium N-(3-imidazol-1-ylpropyl)carbamodithioate
CID 57326228
2-(1H-imidazol-1-yl)ethanamine
CID 430667
1-(3-isocyanopropyl)-1H-imidazole
CID 2769503
5,6,7,8-Tetrahydroimidazo(1,2-a)pyrazine
CID 13247046
[3-(1H-imidazol-1-yl)propyl](methyl)amine
CID 15034982
4-(1H-imidazol-1-yl)piperidine
CID 15789922

Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The IUPAC name of 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (CID 135625409) is 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The canonical SMILES for 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is c1cn2c(n1)NCCC2.
What is the InChIKey of 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The InChIKey is VCZBRPRKZKPDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-2-7-6-8-3-5-9(6)4-1/h3,5H,1-2,4H2,(H,7,8).
What are the key properties of 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine has a molecular weight of 123.16 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 135625409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).