1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine

C9H16F3N5 — CID 105230789

IUPAC1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine
SMILESCn1ncc(C(CCCC(F)(F)F)NN)c1N
InChIInChI=1S/C9H16F3N5/c1-17-8(13)6(5-15-17)7(16-14)3-2-4-9(10,11)12/h5,7,16H,2-4,13-14H2,1H3
InChIKeyXGXTUXHNWUBPTI-UHFFFAOYSA-N
MW251.26 g/mol
LogP1.24
Rot. Bonds5

About 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine

1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine (PubChem CID 105230789) has the molecular formula C9H16F3N5 and a molecular weight of 251.26 g/mol. Its IUPAC name is 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine
PubChem CID105230789
Molecular FormulaC9H16F3N5
Molecular Weight251.26 g/mol
Exact Mass251.14
IUPAC Name1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine
SMILESCn1ncc(C(CCCC(F)(F)F)NN)c1N
InChIInChI=1S/C9H16F3N5/c1-17-8(13)6(5-15-17)7(16-14)3-2-4-9(10,11)12/h5,7,16H,2-4,13-14H2,1H3
InChIKeyXGXTUXHNWUBPTI-UHFFFAOYSA-N
XLogP1.24
TPSA81.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.26
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine 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

1,1,1-trifluoro-N-methyl-5-(1-methylpyrazol-4-yl)pentan-3-amine
CID 103009517
6,6,6-Trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-amine
CID 103011400
[1-(4,4-Difluorocyclohexyl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025552
[6,6,6-Trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
CID 103025573
[3-(1-Methylpyrazol-4-yl)-1-[3-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 103025606
[3-(1-Methylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 103025659
[1,1,1-Trifluoro-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine
CID 103025722
[3-(1-Methylpyrazol-4-yl)-1-[4-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 103025745
[1,1,1-Trifluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
CID 103025856
[1,1-Difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
CID 103027033
[3,3,3-Trifluoro-1-(1-methylpyrazol-4-yl)-2-(trifluoromethyl)propyl]hydrazine
CID 103312733
[4,4,4-Trifluoro-1-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)butan-2-yl]hydrazine
CID 103312744

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine (CID 105230789) is 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine is Cn1ncc(C(CCCC(F)(F)F)NN)c1N.
What is the InChIKey of 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine?
The InChIKey is XGXTUXHNWUBPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3N5/c1-17-8(13)6(5-15-17)7(16-14)3-2-4-9(10,11)12/h5,7,16H,2-4,13-14H2,1H3.
What are the key properties of 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine?
1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine has a molecular weight of 251.26 g/mol, XLogP of 1.24, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)pyrazol-5-amine is sourced from PubChem (CID 105230789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).