(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine

C24H24N4 — CID 5351068

IUPAC(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine
SMILESC/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1cccnc1
InChIInChI=1S/C24H24N4/c1-18(19-7-6-12-25-17-19)26-28-15-13-27(14-16-28)24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24/h2-12,17,24H,13-16H2,1H3/b26-18+
InChIKeyLYRHBDYLHIRALJ-NLRVBDNBSA-N
MW368.48 g/mol
LogP4.19
Rot. Bonds3

About (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine

(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine (PubChem CID 5351068) has the molecular formula C24H24N4 and a molecular weight of 368.48 g/mol. Its IUPAC name is (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine.

Molecular Properties

Compound Name(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine
PubChem CID5351068
Molecular FormulaC24H24N4
Molecular Weight368.48 g/mol
Exact Mass368.20
IUPAC Name(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine
SMILESC/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1cccnc1
InChIInChI=1S/C24H24N4/c1-18(19-7-6-12-25-17-19)26-28-15-13-27(14-16-28)24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24/h2-12,17,24H,13-16H2,1H3/b26-18+
InChIKeyLYRHBDYLHIRALJ-NLRVBDNBSA-N
XLogP4.19
TPSA31.73 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The IUPAC name of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine (CID 5351068) is (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine.
What is the SMILES notation for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The canonical SMILES for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine is C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1cccnc1.
What is the InChIKey of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The InChIKey is LYRHBDYLHIRALJ-NLRVBDNBSA-N. The full InChI is InChI=1S/C24H24N4/c1-18(19-7-6-12-25-17-19)26-28-15-13-27(14-16-28)24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24/h2-12,17,24H,13-16H2,1H3/b26-18+.
What are the key properties of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine has a molecular weight of 368.48 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine is sourced from PubChem (CID 5351068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).