4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine

C20H24N6O — CID 165433919

IUPAC4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine
SMILESc1nc(N2CCCCC2)cc(N2CCN(c3nccc4occc34)CC2)n1
InChIInChI=1S/C20H24N6O/c1-2-7-24(8-3-1)18-14-19(23-15-22-18)25-9-11-26(12-10-25)20-16-5-13-27-17(16)4-6-21-20/h4-6,13-15H,1-3,7-12H2
InChIKeyZLGROEACRFYMRO-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.93
Rot. Bonds3

About 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine

4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine (PubChem CID 165433919) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine.

Molecular Properties

Compound Name4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine
PubChem CID165433919
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine
SMILESc1nc(N2CCCCC2)cc(N2CCN(c3nccc4occc34)CC2)n1
InChIInChI=1S/C20H24N6O/c1-2-7-24(8-3-1)18-14-19(23-15-22-18)25-9-11-26(12-10-25)20-16-5-13-27-17(16)4-6-21-20/h4-6,13-15H,1-3,7-12H2
InChIKeyZLGROEACRFYMRO-UHFFFAOYSA-N
XLogP2.93
TPSA61.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-piperazin-1-ylfuro[3,2-c]pyridine;dihydrochloride
CID 134830355
1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 112856077
4-[4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]furo[3,2-c]pyridine
CID 165434054
4-[4-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)piperazin-1-yl]furo[3,2-c]pyridine
CID 165433903
4-(4-pyrimidin-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 112855694
4-(2,2-difluoro-6-azaspiro[2.5]octan-6-yl)furo[3,2-c]pyridine
CID 172900403
4-[(3R)-3-methylpiperazin-1-yl]furo[3,2-c]pyridine
CID 106535397
4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine
CID 138039104
4-[4-(3,5-dichloro-2-pyridinyl)piperazin-1-yl]-6-piperidin-1-ylpyrimidine
CID 133297534
(3R)-1-furo[3,2-c]pyridin-4-ylpyrrolidin-3-amine
CID 129414537
4-[6-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
CID 155976528
4-(3-bromopyrrolidin-1-yl)furo[3,2-c]pyridine
CID 106535691

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine?
The IUPAC name of 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine (CID 165433919) is 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine.
What is the SMILES notation for 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine?
The canonical SMILES for 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine is c1nc(N2CCCCC2)cc(N2CCN(c3nccc4occc34)CC2)n1.
What is the InChIKey of 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine?
The InChIKey is ZLGROEACRFYMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-2-7-24(8-3-1)18-14-19(23-15-22-18)25-9-11-26(12-10-25)20-16-5-13-27-17(16)4-6-21-20/h4-6,13-15H,1-3,7-12H2.
What are the key properties of 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine?
4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine has a molecular weight of 364.45 g/mol, XLogP of 2.93, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]furo[3,2-c]pyridine is sourced from PubChem (CID 165433919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).