[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine

C14H22N4O2 — CID 105339521

IUPAC[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine
SMILESCOc1cnn(C(C)C)c1C(CCc1ccco1)NN
InChIInChI=1S/C14H22N4O2/c1-10(2)18-14(13(19-3)9-16-18)12(17-15)7-6-11-5-4-8-20-11/h4-5,8-10,12,17H,6-7,15H2,1-3H3
InChIKeyKRYBHZFXNFPPDU-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.20
Rot. Bonds7

About [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine

[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine (PubChem CID 105339521) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine
PubChem CID105339521
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine
SMILESCOc1cnn(C(C)C)c1C(CCc1ccco1)NN
InChIInChI=1S/C14H22N4O2/c1-10(2)18-14(13(19-3)9-16-18)12(17-15)7-6-11-5-4-8-20-11/h4-5,8-10,12,17H,6-7,15H2,1-3H3
InChIKeyKRYBHZFXNFPPDU-UHFFFAOYSA-N
XLogP2.20
TPSA78.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine?
The IUPAC name of [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine (CID 105339521) is [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine.
What is the SMILES notation for [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine?
The canonical SMILES for [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine is COc1cnn(C(C)C)c1C(CCc1ccco1)NN.
What is the InChIKey of [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine?
The InChIKey is KRYBHZFXNFPPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10(2)18-14(13(19-3)9-16-18)12(17-15)7-6-11-5-4-8-20-11/h4-5,8-10,12,17H,6-7,15H2,1-3H3.
What are the key properties of [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine?
[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine has a molecular weight of 278.36 g/mol, XLogP of 2.20, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine is sourced from PubChem (CID 105339521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).