1-pyrimidin-4-ylpent-4-enylhydrazine

C9H14N4 — CID 105221008

IUPAC1-pyrimidin-4-ylpent-4-enylhydrazine
SMILESC=CCCC(NN)c1ccncn1
InChIInChI=1S/C9H14N4/c1-2-3-4-9(13-10)8-5-6-11-7-12-8/h2,5-7,9,13H,1,3-4,10H2
InChIKeyIYKRWQLNSBTSAV-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.95
Rot. Bonds5

About 1-pyrimidin-4-ylpent-4-enylhydrazine

1-pyrimidin-4-ylpent-4-enylhydrazine (PubChem CID 105221008) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-pyrimidin-4-ylpent-4-enylhydrazine.

Molecular Properties

Compound Name1-pyrimidin-4-ylpent-4-enylhydrazine
PubChem CID105221008
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name1-pyrimidin-4-ylpent-4-enylhydrazine
SMILESC=CCCC(NN)c1ccncn1
InChIInChI=1S/C9H14N4/c1-2-3-4-9(13-10)8-5-6-11-7-12-8/h2,5-7,9,13H,1,3-4,10H2
InChIKeyIYKRWQLNSBTSAV-UHFFFAOYSA-N
XLogP0.95
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-pyridin-4-ylpent-4-enylhydrazine
CID 105196473
1-pyrimidin-4-yldecylhydrazine
CID 105220997
1-[5-(trifluoromethyl)-2-pyridinyl]pent-4-enylhydrazine
CID 105311544
1-(6-methoxypyrimidin-4-yl)pent-4-enylhydrazine
CID 102953290
N-ethyl-1-pyrimidin-4-ylbut-3-en-1-amine
CID 63990208
1-(1,2,5-thiadiazol-3-yl)pent-4-enylhydrazine
CID 105311515
1-(3-bromo-2-pyridinyl)pent-4-enylhydrazine
CID 105268068
(2-pyridin-2-yl-1-pyrimidin-4-ylethyl)hydrazine
CID 105220883
1-(1-methylimidazol-4-yl)pent-4-enylhydrazine
CID 107979159
1-(thiadiazol-4-yl)pent-4-enylhydrazine
CID 105311505
(2-pyridin-3-yl-1-pyrimidin-4-ylethyl)hydrazine
CID 105221030
[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine
CID 105220906

Frequently Asked Questions

What is the IUPAC name of 1-pyrimidin-4-ylpent-4-enylhydrazine?
The IUPAC name of 1-pyrimidin-4-ylpent-4-enylhydrazine (CID 105221008) is 1-pyrimidin-4-ylpent-4-enylhydrazine.
What is the SMILES notation for 1-pyrimidin-4-ylpent-4-enylhydrazine?
The canonical SMILES for 1-pyrimidin-4-ylpent-4-enylhydrazine is C=CCCC(NN)c1ccncn1.
What is the InChIKey of 1-pyrimidin-4-ylpent-4-enylhydrazine?
The InChIKey is IYKRWQLNSBTSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-2-3-4-9(13-10)8-5-6-11-7-12-8/h2,5-7,9,13H,1,3-4,10H2.
What are the key properties of 1-pyrimidin-4-ylpent-4-enylhydrazine?
1-pyrimidin-4-ylpent-4-enylhydrazine has a molecular weight of 178.24 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrimidin-4-ylpent-4-enylhydrazine is sourced from PubChem (CID 105221008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).