7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile

C26H30N8O — CID 164920416

IUPAC7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile
SMILESCC(=N\C1CC2(CCNCC2)C1)/C(=N\N)c1cc(OC(C)c2ccccn2)n2c(C#N)cnc2c1
InChIInChI=1S/C26H30N8O/c1-17(32-20-13-26(14-20)6-9-29-10-7-26)25(33-28)19-11-23-31-16-21(15-27)34(23)24(12-19)35-18(2)22-5-3-4-8-30-22/h3-5,8,11-12,16,18,20,29H,6-7,9-10,13-14,28H2,1-2H3/b32-17+,33-25+
InChIKeyGAFRJVAKNZMVMU-FHTBANOLSA-N
MW470.58 g/mol
LogP3.40
Rot. Bonds6

About 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile

7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile (PubChem CID 164920416) has the molecular formula C26H30N8O and a molecular weight of 470.58 g/mol. Its IUPAC name is 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile
PubChem CID164920416
Molecular FormulaC26H30N8O
Molecular Weight470.58 g/mol
Exact Mass470.25
IUPAC Name7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile
SMILESCC(=N\C1CC2(CCNCC2)C1)/C(=N\N)c1cc(OC(C)c2ccccn2)n2c(C#N)cnc2c1
InChIInChI=1S/C26H30N8O/c1-17(32-20-13-26(14-20)6-9-29-10-7-26)25(33-28)19-11-23-31-16-21(15-27)34(23)24(12-19)35-18(2)22-5-3-4-8-30-22/h3-5,8,11-12,16,18,20,29H,6-7,9-10,13-14,28H2,1-2H3/b32-17+,33-25+
InChIKeyGAFRJVAKNZMVMU-FHTBANOLSA-N
XLogP3.40
TPSA125.98 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.58
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile?
The IUPAC name of 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile (CID 164920416) is 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile.
What is the SMILES notation for 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile?
The canonical SMILES for 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile is CC(=N\C1CC2(CCNCC2)C1)/C(=N\N)c1cc(OC(C)c2ccccn2)n2c(C#N)cnc2c1.
What is the InChIKey of 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile?
The InChIKey is GAFRJVAKNZMVMU-FHTBANOLSA-N. The full InChI is InChI=1S/C26H30N8O/c1-17(32-20-13-26(14-20)6-9-29-10-7-26)25(33-28)19-11-23-31-16-21(15-27)34(23)24(12-19)35-18(2)22-5-3-4-8-30-22/h3-5,8,11-12,16,18,20,29H,6-7,9-10,13-14,28H2,1-2H3/b32-17+,33-25+.
What are the key properties of 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile?
7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile has a molecular weight of 470.58 g/mol, XLogP of 3.40, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(7-azaspiro[3.5]nonan-2-ylimino)propanehydrazonoyl]-5-(1-pyridin-2-ylethoxy)imidazo[1,2-a]pyridine-3-carbonitrile is sourced from PubChem (CID 164920416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).