[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine

C14H18F2N4 — CID 103026693

IUPAC[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine
SMILESCn1nccc1CCC(Cc1cc(F)cc(F)c1)NN
InChIInChI=1S/C14H18F2N4/c1-20-14(4-5-18-20)3-2-13(19-17)8-10-6-11(15)9-12(16)7-10/h4-7,9,13,19H,2-3,8,17H2,1H3
InChIKeyRNCPUOSZOVRKMT-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.71
Rot. Bonds6

About [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine

[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine (PubChem CID 103026693) has the molecular formula C14H18F2N4 and a molecular weight of 280.32 g/mol. Its IUPAC name is [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine
PubChem CID103026693
Molecular FormulaC14H18F2N4
Molecular Weight280.32 g/mol
Exact Mass280.15
IUPAC Name[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine
SMILESCn1nccc1CCC(Cc1cc(F)cc(F)c1)NN
InChIInChI=1S/C14H18F2N4/c1-20-14(4-5-18-20)3-2-13(19-17)8-10-6-11(15)9-12(16)7-10/h4-7,9,13,19H,2-3,8,17H2,1H3
InChIKeyRNCPUOSZOVRKMT-UHFFFAOYSA-N
XLogP1.71
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.71
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'}

Analyze [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-(3-fluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103009449
[1-(2,6-dichlorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine
CID 103026695
1-(3,4-difluorophenyl)-N-methyl-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103031007
[1-(3,5-difluorophenyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105413124
1-(3,4-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103030412
2-[(3-fluorophenyl)methyl]-N-methyl-4-(2-methylpyrazol-3-yl)butan-1-amine
CID 103014372
1-(3-chlorophenyl)-N-methyl-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103009058
1-[3-fluoro-5-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]butan-2-amine
CID 103013256
2-(3,5-difluorophenyl)-N-methyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 63963304
[1-(3,5-difluorophenyl)-5-methoxypentan-2-yl]hydrazine
CID 105206742
3-(2-methylpyrazol-3-yl)-1-(3,4,5-trifluorophenyl)propan-1-amine
CID 103009601
[1-(3,5-difluorophenyl)-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105206643

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine?
The IUPAC name of [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine (CID 103026693) is [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine?
The canonical SMILES for [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine is Cn1nccc1CCC(Cc1cc(F)cc(F)c1)NN.
What is the InChIKey of [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine?
The InChIKey is RNCPUOSZOVRKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N4/c1-20-14(4-5-18-20)3-2-13(19-17)8-10-6-11(15)9-12(16)7-10/h4-7,9,13,19H,2-3,8,17H2,1H3.
What are the key properties of [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine?
[1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine has a molecular weight of 280.32 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-difluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 103026693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).