[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine

C17H26N4 — CID 105312665

IUPAC[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine
SMILESCc1ccccc1CCC(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C17H26N4/c1-13(2)21-11-10-17(20-21)12-16(19-18)9-8-15-7-5-4-6-14(15)3/h4-7,10-11,13,16,19H,8-9,12,18H2,1-3H3
InChIKeyIWZDSPWFGCRUFW-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.78
Rot. Bonds7

About [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine

[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine (PubChem CID 105312665) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine
PubChem CID105312665
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC Name[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine
SMILESCc1ccccc1CCC(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C17H26N4/c1-13(2)21-11-10-17(20-21)12-16(19-18)9-8-15-7-5-4-6-14(15)3/h4-7,10-11,13,16,19H,8-9,12,18H2,1-3H3
InChIKeyIWZDSPWFGCRUFW-UHFFFAOYSA-N
XLogP2.78
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.78
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

[1-(2,5-dimethylpyrazol-3-yl)-4-(2-methylphenyl)butan-2-yl]hydrazine
CID 105315719
[4-(2-methylphenyl)-1-pyridin-4-ylbutan-2-yl]hydrazine
CID 105317453
[1-(3-chloro-2-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105264289
1-(2-methylphenyl)hex-5-en-3-ylhydrazine
CID 105289536
[1-(2-fluoro-3-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312794
4-(2-methylphenyl)butan-2-ylhydrazine
CID 105282545
N-methyl-1-(1-propan-2-ylpyrazol-3-yl)-4-pyridin-3-ylbutan-2-amine
CID 105154860
1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64770812
[1-(2-chloro-4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105216085
[1-(3,4-difluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105312820
[1-(1-methylpyrazol-3-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
CID 105329556
[1-cyclopropyl-5-(2-methylphenyl)pentan-3-yl]hydrazine
CID 105315024

Frequently Asked Questions

What is the IUPAC name of [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine?
The IUPAC name of [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine (CID 105312665) is [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine?
The canonical SMILES for [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine is Cc1ccccc1CCC(Cc1ccn(C(C)C)n1)NN.
What is the InChIKey of [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine?
The InChIKey is IWZDSPWFGCRUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-13(2)21-11-10-17(20-21)12-16(19-18)9-8-15-7-5-4-6-14(15)3/h4-7,10-11,13,16,19H,8-9,12,18H2,1-3H3.
What are the key properties of [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine?
[4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine has a molecular weight of 286.42 g/mol, XLogP of 2.78, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylphenyl)-1-(1-propan-2-ylpyrazol-3-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 105312665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).