N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine

C12H25N5 — CID 62246707

IUPACN-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine
SMILESCCC(C)CN(C)Cc1c(C)nn(C)c1NN
InChIInChI=1S/C12H25N5/c1-6-9(2)7-16(4)8-11-10(3)15-17(5)12(11)14-13/h9,14H,6-8,13H2,1-5H3
InChIKeyDZCFNCXUBCYZDS-UHFFFAOYSA-N
MW239.37 g/mol
LogP1.49
Rot. Bonds6

About N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine

N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine (PubChem CID 62246707) has the molecular formula C12H25N5 and a molecular weight of 239.37 g/mol. Its IUPAC name is N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine
PubChem CID62246707
Molecular FormulaC12H25N5
Molecular Weight239.37 g/mol
Exact Mass239.21
IUPAC NameN-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine
SMILESCCC(C)CN(C)Cc1c(C)nn(C)c1NN
InChIInChI=1S/C12H25N5/c1-6-9(2)7-16(4)8-11-10(3)15-17(5)12(11)14-13/h9,14H,6-8,13H2,1-5H3
InChIKeyDZCFNCXUBCYZDS-UHFFFAOYSA-N
XLogP1.49
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 51.49
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 N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine?
The IUPAC name of N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine (CID 62246707) is N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine.
What is the SMILES notation for N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine?
The canonical SMILES for N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine is CCC(C)CN(C)Cc1c(C)nn(C)c1NN.
What is the InChIKey of N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine?
The InChIKey is DZCFNCXUBCYZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N5/c1-6-9(2)7-16(4)8-11-10(3)15-17(5)12(11)14-13/h9,14H,6-8,13H2,1-5H3.
What are the key properties of N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine?
N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine has a molecular weight of 239.37 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 62246707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).