8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine

C15H17N5 — CID 80790130

IUPAC8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESNc1cn2ccnc2c(NCCCc2ccccc2)n1
InChIInChI=1S/C15H17N5/c16-13-11-20-10-9-18-15(20)14(19-13)17-8-4-7-12-5-2-1-3-6-12/h1-3,5-6,9-11H,4,7-8,16H2,(H,17,19)
InChIKeyASINJLFXIMAMFY-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.36
Rot. Bonds5

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

8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80790130) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80790130
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESNc1cn2ccnc2c(NCCCc2ccccc2)n1
InChIInChI=1S/C15H17N5/c16-13-11-20-10-9-18-15(20)14(19-13)17-8-4-7-12-5-2-1-3-6-12/h1-3,5-6,9-11H,4,7-8,16H2,(H,17,19)
InChIKeyASINJLFXIMAMFY-UHFFFAOYSA-N
XLogP2.36
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80824349
8-N-(2-propylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80808245
3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylpropanamide
CID 80814263
8-N-(1,2-oxazol-5-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 114187084
8-N-[(1-methylimidazol-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80829250
methyl 2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]acetate
CID 80776875
8-N-(4-ethylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80761933
1-tert-butyl-3-(3-phenylpropylamino)pyrazin-2-one
CID 62938464
8-N-[(6-methoxy-3-pyridinyl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80831802
8-N-[(3-methyl-4-pyridinyl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 114702239
8-N-[(5-chlorothiophen-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80836363
8-N-[3-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80802251

Frequently Asked Questions

What is the IUPAC name of 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80790130) is 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine is Nc1cn2ccnc2c(NCCCc2ccccc2)n1.
What is the InChIKey of 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is ASINJLFXIMAMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c16-13-11-20-10-9-18-15(20)14(19-13)17-8-4-7-12-5-2-1-3-6-12/h1-3,5-6,9-11H,4,7-8,16H2,(H,17,19).
What are the key properties of 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 267.34 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(3-phenylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80790130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).