N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide

C15H24N2O2 — CID 134860431

IUPACN'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide
SMILESC=CCC(C)(CCCCC)NNC(=O)c1ccco1
InChIInChI=1S/C15H24N2O2/c1-4-6-7-11-15(3,10-5-2)17-16-14(18)13-9-8-12-19-13/h5,8-9,12,17H,2,4,6-7,10-11H2,1,3H3,(H,16,18)
InChIKeyLBRNOSZMUDVCIK-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.43
Rot. Bonds9

About N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide

N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide (PubChem CID 134860431) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide
PubChem CID134860431
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide
SMILESC=CCC(C)(CCCCC)NNC(=O)c1ccco1
InChIInChI=1S/C15H24N2O2/c1-4-6-7-11-15(3,10-5-2)17-16-14(18)13-9-8-12-19-13/h5,8-9,12,17H,2,4,6-7,10-11H2,1,3H3,(H,16,18)
InChIKeyLBRNOSZMUDVCIK-UHFFFAOYSA-N
XLogP3.43
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide?
The IUPAC name of N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide (CID 134860431) is N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide?
The canonical SMILES for N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide is C=CCC(C)(CCCCC)NNC(=O)c1ccco1.
What is the InChIKey of N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide?
The InChIKey is LBRNOSZMUDVCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-6-7-11-15(3,10-5-2)17-16-14(18)13-9-8-12-19-13/h5,8-9,12,17H,2,4,6-7,10-11H2,1,3H3,(H,16,18).
What are the key properties of N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide?
N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide has a molecular weight of 264.37 g/mol, XLogP of 3.43, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methylnon-1-en-4-yl)furan-2-carbohydrazide is sourced from PubChem (CID 134860431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).