6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine

C20H21N7 — CID 168976860

IUPAC6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine
SMILESCc1cn2cc(-c3cc4ccc(N5CCNCC5)nc4cn3)nc(C)c2n1
InChIInChI=1S/C20H21N7/c1-13-11-27-12-18(24-14(2)20(27)23-13)16-9-15-3-4-19(25-17(15)10-22-16)26-7-5-21-6-8-26/h3-4,9-12,21H,5-8H2,1-2H3
InChIKeyPTUXKGKCULXSHY-UHFFFAOYSA-N
MW359.44 g/mol
LogP2.37
Rot. Bonds2

About 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine

6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine (PubChem CID 168976860) has the molecular formula C20H21N7 and a molecular weight of 359.44 g/mol. Its IUPAC name is 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine.

Molecular Properties

Compound Name6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine
PubChem CID168976860
Molecular FormulaC20H21N7
Molecular Weight359.44 g/mol
Exact Mass359.19
IUPAC Name6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine
SMILESCc1cn2cc(-c3cc4ccc(N5CCNCC5)nc4cn3)nc(C)c2n1
InChIInChI=1S/C20H21N7/c1-13-11-27-12-18(24-14(2)20(27)23-13)16-9-15-3-4-19(25-17(15)10-22-16)26-7-5-21-6-8-26/h3-4,9-12,21H,5-8H2,1-2H3
InChIKeyPTUXKGKCULXSHY-UHFFFAOYSA-N
XLogP2.37
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.44
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine?
The IUPAC name of 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine (CID 168976860) is 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine.
What is the SMILES notation for 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine?
The canonical SMILES for 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine is Cc1cn2cc(-c3cc4ccc(N5CCNCC5)nc4cn3)nc(C)c2n1.
What is the InChIKey of 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine?
The InChIKey is PTUXKGKCULXSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7/c1-13-11-27-12-18(24-14(2)20(27)23-13)16-9-15-3-4-19(25-17(15)10-22-16)26-7-5-21-6-8-26/h3-4,9-12,21H,5-8H2,1-2H3.
What are the key properties of 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine?
6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine has a molecular weight of 359.44 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-2-piperazin-1-yl-1,7-naphthyridine is sourced from PubChem (CID 168976860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).