(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde

C8H10N2O — CID 23262575

IUPAC(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde
SMILESCN(C)/N=C1\C=CC=C1C=O
InChIInChI=1S/C8H10N2O/c1-10(2)9-8-5-3-4-7(8)6-11/h3-6H,1-2H3/b9-8+
InChIKeyKPCGBLHRJUPGPN-CMDGGOBGSA-N
MW150.18 g/mol
LogP0.60
Rot. Bonds2

About (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde

(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde (PubChem CID 23262575) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde.

Molecular Properties

Compound Name(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde
PubChem CID23262575
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde
SMILESCN(C)/N=C1\C=CC=C1C=O
InChIInChI=1S/C8H10N2O/c1-10(2)9-8-5-3-4-7(8)6-11/h3-6H,1-2H3/b9-8+
InChIKeyKPCGBLHRJUPGPN-CMDGGOBGSA-N
XLogP0.60
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde?
The IUPAC name of (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde (CID 23262575) is (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde.
What is the SMILES notation for (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde?
The canonical SMILES for (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde is CN(C)/N=C1\C=CC=C1C=O.
What is the InChIKey of (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde?
The InChIKey is KPCGBLHRJUPGPN-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10(2)9-8-5-3-4-7(8)6-11/h3-6H,1-2H3/b9-8+.
What are the key properties of (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde?
(5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde has a molecular weight of 150.18 g/mol, XLogP of 0.60, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(dimethylhydrazinylidene)cyclopenta-1,3-diene-1-carbaldehyde is sourced from PubChem (CID 23262575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).