N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine

C12H17N5 — CID 80797840

IUPACN-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(N2CCC(C)C2)n1
InChIInChI=1S/C12H17N5/c1-9-3-5-16(7-9)12-11-14-4-6-17(11)8-10(13-2)15-12/h4,6,8-9,13H,3,5,7H2,1-2H3
InChIKeyBYJQFEIBMNEUTP-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.62
Rot. Bonds2

About N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine

N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80797840) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound NameN-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80797840
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC NameN-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(N2CCC(C)C2)n1
InChIInChI=1S/C12H17N5/c1-9-3-5-16(7-9)12-11-14-4-6-17(11)8-10(13-2)15-12/h4,6,8-9,13H,3,5,7H2,1-2H3
InChIKeyBYJQFEIBMNEUTP-UHFFFAOYSA-N
XLogP1.62
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine (CID 80797840) is N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine is CNc1cn2ccnc2c(N2CCC(C)C2)n1.
What is the InChIKey of N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is BYJQFEIBMNEUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-9-3-5-16(7-9)12-11-14-4-6-17(11)8-10(13-2)15-12/h4,6,8-9,13H,3,5,7H2,1-2H3.
What are the key properties of N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 231.30 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80797840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).