[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine

C13H26N4 — CID 105312810

IUPAC[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine
SMILESCCC(C)(C)C(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C13H26N4/c1-6-13(4,5)12(15-14)9-11-7-8-17(16-11)10(2)3/h7-8,10,12,15H,6,9,14H2,1-5H3
InChIKeySJNBULMERZOZDR-UHFFFAOYSA-N
MW238.38 g/mol
LogP2.27
Rot. Bonds6

About [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine

[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine (PubChem CID 105312810) has the molecular formula C13H26N4 and a molecular weight of 238.38 g/mol. Its IUPAC name is [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine
PubChem CID105312810
Molecular FormulaC13H26N4
Molecular Weight238.38 g/mol
Exact Mass238.22
IUPAC Name[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine
SMILESCCC(C)(C)C(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C13H26N4/c1-6-13(4,5)12(15-14)9-11-7-8-17(16-11)10(2)3/h7-8,10,12,15H,6,9,14H2,1-5H3
InChIKeySJNBULMERZOZDR-UHFFFAOYSA-N
XLogP2.27
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 52.27
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

N,N-diethyl-3-hydrazinyl-2-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-2-amine
CID 105239181
[3-methyl-3-phenyl-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine
CID 105216281
N-ethyl-3-methoxy-3-methyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
CID 116758057
3-methoxy-N,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)butan-2-amine
CID 79198374
3-methoxy-3-methyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
CID 116757473
2,2-dimethyl-N-[(1-propan-2-ylpyrazol-3-yl)methyl]butan-1-amine
CID 103699639
[3-methoxy-1-(1-propan-2-ylpyrazol-3-yl)hexan-2-yl]hydrazine
CID 105271606
N,N-diethyl-3-hydrazinyl-2-methyl-4-(1-methylpyrazol-3-yl)butan-2-amine
CID 105239262
3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine
CID 105025716
2,3-dimethyl-4-(1-propan-2-ylpyrazol-3-yl)butan-1-amine
CID 81009886
2-(1-propan-2-ylpyrazol-3-yl)ethylhydrazine
CID 105220698
[1-(3,4-difluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105312820

Frequently Asked Questions

What is the IUPAC name of [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine?
The IUPAC name of [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine (CID 105312810) is [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine.
What is the SMILES notation for [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine?
The canonical SMILES for [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine is CCC(C)(C)C(Cc1ccn(C(C)C)n1)NN.
What is the InChIKey of [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine?
The InChIKey is SJNBULMERZOZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4/c1-6-13(4,5)12(15-14)9-11-7-8-17(16-11)10(2)3/h7-8,10,12,15H,6,9,14H2,1-5H3.
What are the key properties of [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine?
[3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine has a molecular weight of 238.38 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3-dimethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-yl]hydrazine is sourced from PubChem (CID 105312810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).