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

C16H17N5 — CID 80798456

IUPAC8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(N2CCC(c3ccccc3)C2)n1
InChIInChI=1S/C16H17N5/c17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-13(10-20)12-4-2-1-3-5-12/h1-5,7,9,11,13H,6,8,10,17H2
InChIKeyDJFUNNNKMMUHOW-UHFFFAOYSA-N
MW279.35 g/mol
LogP2.31
Rot. Bonds2

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

8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80798456) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80798456
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(N2CCC(c3ccccc3)C2)n1
InChIInChI=1S/C16H17N5/c17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-13(10-20)12-4-2-1-3-5-12/h1-5,7,9,11,13H,6,8,10,17H2
InChIKeyDJFUNNNKMMUHOW-UHFFFAOYSA-N
XLogP2.31
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine (CID 80798456) is 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine is Nc1cn2ccnc2c(N2CCC(c3ccccc3)C2)n1.
What is the InChIKey of 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is DJFUNNNKMMUHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-13(10-20)12-4-2-1-3-5-12/h1-5,7,9,11,13H,6,8,10,17H2.
What are the key properties of 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine?
8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 279.35 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-phenylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80798456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).