[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine

C14H20ClN5 — CID 105263746

IUPAC[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1ncccc1CC
InChIInChI=1S/C14H20ClN5/c1-3-8-20-14(11(15)9-18-20)13(19-16)12-10(4-2)6-5-7-17-12/h5-7,9,13,19H,3-4,8,16H2,1-2H3
InChIKeySGRBGCBPPKNFQA-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.46
Rot. Bonds6

About [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine

[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine (PubChem CID 105263746) has the molecular formula C14H20ClN5 and a molecular weight of 293.80 g/mol. Its IUPAC name is [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine
PubChem CID105263746
Molecular FormulaC14H20ClN5
Molecular Weight293.80 g/mol
Exact Mass293.14
IUPAC Name[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1ncccc1CC
InChIInChI=1S/C14H20ClN5/c1-3-8-20-14(11(15)9-18-20)13(19-16)12-10(4-2)6-5-7-17-12/h5-7,9,13,19H,3-4,8,16H2,1-2H3
InChIKeySGRBGCBPPKNFQA-UHFFFAOYSA-N
XLogP2.46
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine (CID 105263746) is [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine is CCCn1ncc(Cl)c1C(NN)c1ncccc1CC.
What is the InChIKey of [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine?
The InChIKey is SGRBGCBPPKNFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN5/c1-3-8-20-14(11(15)9-18-20)13(19-16)12-10(4-2)6-5-7-17-12/h5-7,9,13,19H,3-4,8,16H2,1-2H3.
What are the key properties of [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine?
[(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine has a molecular weight of 293.80 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-propylpyrazol-5-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105263746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).