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

C14H23N5 — CID 83147491

IUPAC6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCNc1cn2ccnc2c(NCC(C)C(C)(C)C)n1
InChIInChI=1S/C14H23N5/c1-10(14(2,3)4)8-17-12-13-16-6-7-19(13)9-11(15-5)18-12/h6-7,9-10,15H,8H2,1-5H3,(H,17,18)
InChIKeyFNKPHXMPMPBRBC-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.87
Rot. Bonds4

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

6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 83147491) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID83147491
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCNc1cn2ccnc2c(NCC(C)C(C)(C)C)n1
InChIInChI=1S/C14H23N5/c1-10(14(2,3)4)8-17-12-13-16-6-7-19(13)9-11(15-5)18-12/h6-7,9-10,15H,8H2,1-5H3,(H,17,18)
InChIKeyFNKPHXMPMPBRBC-UHFFFAOYSA-N
XLogP2.87
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 83147491) is 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine is CNc1cn2ccnc2c(NCC(C)C(C)(C)C)n1.
What is the InChIKey of 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is FNKPHXMPMPBRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-10(14(2,3)4)8-17-12-13-16-6-7-19(13)9-11(15-5)18-12/h6-7,9-10,15H,8H2,1-5H3,(H,17,18).
What are the key properties of 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine?
6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 261.37 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 83147491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).