3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

C15H13N7 — CID 58873894

IUPAC3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cncc(CNc2nccn3c(-c4cn[nH]c4)cnc23)c1
InChIInChI=1S/C15H13N7/c1-2-11(6-16-3-1)7-18-14-15-19-10-13(12-8-20-21-9-12)22(15)5-4-17-14/h1-6,8-10H,7H2,(H,17,18)(H,20,21)
InChIKeyXELCHFJHEJKDAK-UHFFFAOYSA-N
MW291.32 g/mol
LogP2.13
Rot. Bonds4

About 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 58873894) has the molecular formula C15H13N7 and a molecular weight of 291.32 g/mol. Its IUPAC name is 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID58873894
Molecular FormulaC15H13N7
Molecular Weight291.32 g/mol
Exact Mass291.12
IUPAC Name3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cncc(CNc2nccn3c(-c4cn[nH]c4)cnc23)c1
InChIInChI=1S/C15H13N7/c1-2-11(6-16-3-1)7-18-14-15-19-10-13(12-8-20-21-9-12)22(15)5-4-17-14/h1-6,8-10H,7H2,(H,17,18)(H,20,21)
InChIKeyXELCHFJHEJKDAK-UHFFFAOYSA-N
XLogP2.13
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.32
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (CID 58873894) is 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is c1cncc(CNc2nccn3c(-c4cn[nH]c4)cnc23)c1.
What is the InChIKey of 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is XELCHFJHEJKDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N7/c1-2-11(6-16-3-1)7-18-14-15-19-10-13(12-8-20-21-9-12)22(15)5-4-17-14/h1-6,8-10H,7H2,(H,17,18)(H,20,21).
What are the key properties of 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 291.32 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 58873894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).