8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine

C15H16ClN5 — CID 80736456

IUPAC8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCCNc1cn2ccnc2c(Nc2cccc(Cl)c2)n1
InChIInChI=1S/C15H16ClN5/c1-2-6-17-13-10-21-8-7-18-15(21)14(20-13)19-12-5-3-4-11(16)9-12/h3-5,7-10,17H,2,6H2,1H3,(H,19,20)
InChIKeyQYWCZBLQBAQIJE-UHFFFAOYSA-N
MW301.78 g/mol
LogP3.95
Rot. Bonds5

About 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine

8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80736456) has the molecular formula C15H16ClN5 and a molecular weight of 301.78 g/mol. Its IUPAC name is 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80736456
Molecular FormulaC15H16ClN5
Molecular Weight301.78 g/mol
Exact Mass301.11
IUPAC Name8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCCNc1cn2ccnc2c(Nc2cccc(Cl)c2)n1
InChIInChI=1S/C15H16ClN5/c1-2-6-17-13-10-21-8-7-18-15(21)14(20-13)19-12-5-3-4-11(16)9-12/h3-5,7-10,17H,2,6H2,1H3,(H,19,20)
InChIKeyQYWCZBLQBAQIJE-UHFFFAOYSA-N
XLogP3.95
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.78
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-N-(4-methylphenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80751543
8-N-(3,4-dichlorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80768774
6-N-ethyl-8-N-(3-methoxyphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80751540
6-N-methyl-8-N-(3-methylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80754749
2-N-(3-chlorophenyl)-4-N-propylpyrimidine-2,4-diamine
CID 112881843
8-N-(2-bromo-3-chlorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 103481971
8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80749365
8-N-(2-propan-2-yloxyethyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 104767136
2-methyl-1-[[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]amino]butan-2-ol
CID 80842987
8-N-(2-methylpentan-3-yl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80802760
2-N-(3-chlorophenyl)-6-N-propylpyrazine-2,6-diamine
CID 80760387
N-[2-[[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]amino]ethyl]acetamide
CID 80788012

Frequently Asked Questions

What is the IUPAC name of 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine (CID 80736456) is 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine is CCCNc1cn2ccnc2c(Nc2cccc(Cl)c2)n1.
What is the InChIKey of 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is QYWCZBLQBAQIJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN5/c1-2-6-17-13-10-21-8-7-18-15(21)14(20-13)19-12-5-3-4-11(16)9-12/h3-5,7-10,17H,2,6H2,1H3,(H,19,20).
What are the key properties of 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 301.78 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(3-chlorophenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80736456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).