[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine

C14H18F2N4O — CID 103026236

IUPAC[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccc(OC(F)F)cc1
InChIInChI=1S/C14H18F2N4O/c1-20-11(8-9-18-20)4-7-13(19-17)10-2-5-12(6-3-10)21-14(15)16/h2-3,5-6,8-9,13-14,19H,4,7,17H2,1H3
InChIKeyFTWRFNNBKXXNSY-UHFFFAOYSA-N
MW296.32 g/mol
LogP2.16
Rot. Bonds7

About [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine

[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine (PubChem CID 103026236) has the molecular formula C14H18F2N4O and a molecular weight of 296.32 g/mol. Its IUPAC name is [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine
PubChem CID103026236
Molecular FormulaC14H18F2N4O
Molecular Weight296.32 g/mol
Exact Mass296.14
IUPAC Name[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccc(OC(F)F)cc1
InChIInChI=1S/C14H18F2N4O/c1-20-11(8-9-18-20)4-7-13(19-17)10-2-5-12(6-3-10)21-14(15)16/h2-3,5-6,8-9,13-14,19H,4,7,17H2,1H3
InChIKeyFTWRFNNBKXXNSY-UHFFFAOYSA-N
XLogP2.16
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The IUPAC name of [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine (CID 103026236) is [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine.
What is the SMILES notation for [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The canonical SMILES for [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine is Cn1nccc1CCC(NN)c1ccc(OC(F)F)cc1.
What is the InChIKey of [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The InChIKey is FTWRFNNBKXXNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N4O/c1-20-11(8-9-18-20)4-7-13(19-17)10-2-5-12(6-3-10)21-14(15)16/h2-3,5-6,8-9,13-14,19H,4,7,17H2,1H3.
What are the key properties of [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
[1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine has a molecular weight of 296.32 g/mol, XLogP of 2.16, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(difluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)propyl]hydrazine is sourced from PubChem (CID 103026236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).