[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine

C14H28N4 — CID 105315889

IUPAC[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine
SMILESCc1cc(CC(CC(C)C(C)(C)C)NN)n(C)n1
InChIInChI=1S/C14H28N4/c1-10(14(3,4)5)7-12(16-15)9-13-8-11(2)17-18(13)6/h8,10,12,16H,7,9,15H2,1-6H3
InChIKeyXXJHRDKMOSLBLE-UHFFFAOYSA-N
MW252.41 g/mol
LogP2.18
Rot. Bonds5

About [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine

[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine (PubChem CID 105315889) has the molecular formula C14H28N4 and a molecular weight of 252.41 g/mol. Its IUPAC name is [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine
PubChem CID105315889
Molecular FormulaC14H28N4
Molecular Weight252.41 g/mol
Exact Mass252.23
IUPAC Name[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine
SMILESCc1cc(CC(CC(C)C(C)(C)C)NN)n(C)n1
InChIInChI=1S/C14H28N4/c1-10(14(3,4)5)7-12(16-15)9-13-8-11(2)17-18(13)6/h8,10,12,16H,7,9,15H2,1-6H3
InChIKeyXXJHRDKMOSLBLE-UHFFFAOYSA-N
XLogP2.18
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 52.18
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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Related Compounds

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CID 105315707
4-(2,5-dimethylpyrazol-3-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259282
[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine
CID 105225066
[1-(2,5-dimethylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
CID 105272137
[1-(2,5-dimethylpyrazol-3-yl)-3-ethoxy-4,4-dimethylpentan-2-yl]hydrazine
CID 105273802
[1-(2,5-dimethylphenyl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105315883
[1-(2,5-dimethylpyrazol-3-yl)-4-(2-methylphenyl)butan-2-yl]hydrazine
CID 105315719
[1-(2,5-dimethylpyrazol-3-yl)-3-ethoxybutan-2-yl]hydrazine
CID 105222898
(4,5,5-trimethyl-1-pyridin-4-ylhexan-2-yl)hydrazine
CID 105317608
[1-(2,5-dimethylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560494
1-(2,5-dimethylpyrazol-3-yl)-3,4-dimethylpentan-2-ol
CID 115811450

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine?
The IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine (CID 105315889) is [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine?
The canonical SMILES for [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine is Cc1cc(CC(CC(C)C(C)(C)C)NN)n(C)n1.
What is the InChIKey of [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine?
The InChIKey is XXJHRDKMOSLBLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4/c1-10(14(3,4)5)7-12(16-15)9-13-8-11(2)17-18(13)6/h8,10,12,16H,7,9,15H2,1-6H3.
What are the key properties of [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine?
[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine has a molecular weight of 252.41 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine is sourced from PubChem (CID 105315889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).