[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine

C16H24N4 — CID 103025657

IUPAC[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine
SMILESCc1cccc(CCC(CCc2cnn(C)c2)NN)c1
InChIInChI=1S/C16H24N4/c1-13-4-3-5-14(10-13)6-8-16(19-17)9-7-15-11-18-20(2)12-15/h3-5,10-12,16,19H,6-9,17H2,1-2H3
InChIKeyHQDZGIDHPWHFST-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.13
Rot. Bonds7

About [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine

[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine (PubChem CID 103025657) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine
PubChem CID103025657
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine
SMILESCc1cccc(CCC(CCc2cnn(C)c2)NN)c1
InChIInChI=1S/C16H24N4/c1-13-4-3-5-14(10-13)6-8-16(19-17)9-7-15-11-18-20(2)12-15/h3-5,10-12,16,19H,6-9,17H2,1-2H3
InChIKeyHQDZGIDHPWHFST-UHFFFAOYSA-N
XLogP2.13
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine?
The IUPAC name of [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine (CID 103025657) is [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine.
What is the SMILES notation for [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine?
The canonical SMILES for [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine is Cc1cccc(CCC(CCc2cnn(C)c2)NN)c1.
What is the InChIKey of [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine?
The InChIKey is HQDZGIDHPWHFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-13-4-3-5-14(10-13)6-8-16(19-17)9-7-15-11-18-20(2)12-15/h3-5,10-12,16,19H,6-9,17H2,1-2H3.
What are the key properties of [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine?
[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine has a molecular weight of 272.40 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine is sourced from PubChem (CID 103025657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).