5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide

C10H14N4O — CID 170487393

IUPAC5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide
SMILESNCCC=Cc1cncc(C(=O)NN)c1
InChIInChI=1S/C10H14N4O/c11-4-2-1-3-8-5-9(7-13-6-8)10(15)14-12/h1,3,5-7H,2,4,11-12H2,(H,14,15)
InChIKeyXHFDOODLCSTERY-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.05
Rot. Bonds4

About 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide

5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide (PubChem CID 170487393) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide
PubChem CID170487393
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide
SMILESNCCC=Cc1cncc(C(=O)NN)c1
InChIInChI=1S/C10H14N4O/c11-4-2-1-3-8-5-9(7-13-6-8)10(15)14-12/h1,3,5-7H,2,4,11-12H2,(H,14,15)
InChIKeyXHFDOODLCSTERY-UHFFFAOYSA-N
XLogP0.05
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide with MolForge

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

Launch Full Analysis

Related Compounds

methyl 5-(4-aminobut-1-enyl)pyridine-3-carboxylate
CID 170487339
5-(3-chloroprop-1-enyl)pyridine-3-carbohydrazide
CID 169477771
methyl 5-(3-aminoprop-1-enyl)pyridine-3-carboxylate
CID 169463930
[5-(4-aminobut-1-enyl)-3-pyridinyl]methanol
CID 170486715
1-[5-(4-hydroxybut-1-enyl)-3-pyridinyl]ethanone
CID 170476646
5-(3-chloroprop-1-enyl)pyridine-3-carboxylic acid
CID 169477397
5-(4-azidobut-1-enyl)pyridine-3-carboxamide
CID 170485248
ethyl 5-(3-bromoprop-1-enyl)pyridine-3-carboxylate
CID 169476080
methyl 3-(4-aminobut-1-enyl)benzoate
CID 170487184
3-(4-aminobut-1-enyl)-5-fluorobenzoic acid
CID 170487170
3-(4-aminobut-1-enyl)-5-bromobenzoic acid
CID 170487995
5-[(E,4S)-4-aminopent-1-enyl]pyridine-3-carboxamide;dihydrochloride
CID 178024402

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide?
The IUPAC name of 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide (CID 170487393) is 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide?
The canonical SMILES for 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide is NCCC=Cc1cncc(C(=O)NN)c1.
What is the InChIKey of 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide?
The InChIKey is XHFDOODLCSTERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c11-4-2-1-3-8-5-9(7-13-6-8)10(15)14-12/h1,3,5-7H,2,4,11-12H2,(H,14,15).
What are the key properties of 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide?
5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide has a molecular weight of 206.25 g/mol, XLogP of 0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminobut-1-enyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 170487393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).