4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine

C13H18N4O — CID 68720421

IUPAC4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine
SMILESCCc1c(N)c(N2CCNCC2)nc2occc12
InChIInChI=1S/C13H18N4O/c1-2-9-10-3-8-18-13(10)16-12(11(9)14)17-6-4-15-5-7-17/h3,8,15H,2,4-7,14H2,1H3
InChIKeyRYQMMPSODFRRQS-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.38
Rot. Bonds2

About 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine

4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine (PubChem CID 68720421) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine.

Molecular Properties

Compound Name4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine
PubChem CID68720421
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine
SMILESCCc1c(N)c(N2CCNCC2)nc2occc12
InChIInChI=1S/C13H18N4O/c1-2-9-10-3-8-18-13(10)16-12(11(9)14)17-6-4-15-5-7-17/h3,8,15H,2,4-7,14H2,1H3
InChIKeyRYQMMPSODFRRQS-UHFFFAOYSA-N
XLogP1.38
TPSA67.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine?
The IUPAC name of 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine (CID 68720421) is 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine.
What is the SMILES notation for 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine?
The canonical SMILES for 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine is CCc1c(N)c(N2CCNCC2)nc2occc12.
What is the InChIKey of 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine?
The InChIKey is RYQMMPSODFRRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-2-9-10-3-8-18-13(10)16-12(11(9)14)17-6-4-15-5-7-17/h3,8,15H,2,4-7,14H2,1H3.
What are the key properties of 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine?
4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine has a molecular weight of 246.31 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-piperazin-1-ylfuro[2,3-b]pyridin-5-amine is sourced from PubChem (CID 68720421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).