[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine

C13H18N6S — CID 62471387

IUPAC[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine
SMILESNNc1cc(CN2CCN(c3nccs3)CC2)ccn1
InChIInChI=1S/C13H18N6S/c14-17-12-9-11(1-2-15-12)10-18-4-6-19(7-5-18)13-16-3-8-20-13/h1-3,8-9H,4-7,10,14H2,(H,15,17)
InChIKeyVRKRAHBFZNMCPV-UHFFFAOYSA-N
MW290.40 g/mol
LogP1.15
Rot. Bonds4

About [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine

[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine (PubChem CID 62471387) has the molecular formula C13H18N6S and a molecular weight of 290.40 g/mol. Its IUPAC name is [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine
PubChem CID62471387
Molecular FormulaC13H18N6S
Molecular Weight290.40 g/mol
Exact Mass290.13
IUPAC Name[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine
SMILESNNc1cc(CN2CCN(c3nccs3)CC2)ccn1
InChIInChI=1S/C13H18N6S/c14-17-12-9-11(1-2-15-12)10-18-4-6-19(7-5-18)13-16-3-8-20-13/h1-3,8-9H,4-7,10,14H2,(H,15,17)
InChIKeyVRKRAHBFZNMCPV-UHFFFAOYSA-N
XLogP1.15
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.40
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine (CID 62471387) is [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine is NNc1cc(CN2CCN(c3nccs3)CC2)ccn1.
What is the InChIKey of [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine?
The InChIKey is VRKRAHBFZNMCPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6S/c14-17-12-9-11(1-2-15-12)10-18-4-6-19(7-5-18)13-16-3-8-20-13/h1-3,8-9H,4-7,10,14H2,(H,15,17).
What are the key properties of [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine?
[4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine has a molecular weight of 290.40 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62471387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).