[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine

C10H14ClN3 — CID 105319871

IUPAC[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine
SMILESCC(C)=CC(NN)c1ccncc1Cl
InChIInChI=1S/C10H14ClN3/c1-7(2)5-10(14-12)8-3-4-13-6-9(8)11/h3-6,10,14H,12H2,1-2H3
InChIKeyFHAVLNWOSJZKST-UHFFFAOYSA-N
MW211.70 g/mol
LogP2.21
Rot. Bonds3

About [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine

[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine (PubChem CID 105319871) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine
PubChem CID105319871
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine
SMILESCC(C)=CC(NN)c1ccncc1Cl
InChIInChI=1S/C10H14ClN3/c1-7(2)5-10(14-12)8-3-4-13-6-9(8)11/h3-6,10,14H,12H2,1-2H3
InChIKeyFHAVLNWOSJZKST-UHFFFAOYSA-N
XLogP2.21
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(3-chloro-4-pyridinyl)-3-methylbut-2-en-1-ol
CID 105110237
(3-methyl-1-pyrazin-2-ylbut-2-enyl)hydrazine
CID 105203497
1-(3-chloro-4-pyridinyl)ethanol
CID 67428643
(1S)-1-(3-chloro-4-pyridinyl)ethanol
CID 59186881
1-(3-chloro-4-pyridinyl)-2-methylprop-2-en-1-ol
CID 105110481
1-(3-chloro-4-pyridinyl)-N,2,2-trimethylpropan-1-amine
CID 105146074
1-(3-chloro-4-pyridinyl)-N,2-dimethylprop-2-en-1-amine
CID 105163768
methyl (2R)-2-amino-2-(3-chloro-4-pyridinyl)acetate
CID 130613043
[(3-chloro-4-pyridinyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105285750
[1-(1,5-dimethylpyrazol-4-yl)-3-methylbut-2-enyl]hydrazine
CID 105319839
1-(3-chloro-4-pyridinyl)-3-methylbut-3-en-1-amine
CID 105163006
1-(3-chloro-4-pyridinyl)propan-1-ol
CID 105088541

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine (CID 105319871) is [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine is CC(C)=CC(NN)c1ccncc1Cl.
What is the InChIKey of [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine?
The InChIKey is FHAVLNWOSJZKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c1-7(2)5-10(14-12)8-3-4-13-6-9(8)11/h3-6,10,14H,12H2,1-2H3.
What are the key properties of [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine?
[1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine has a molecular weight of 211.70 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-pyridinyl)-3-methylbut-2-enyl]hydrazine is sourced from PubChem (CID 105319871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).