N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine

C10H19N5 — CID 170459337

IUPACN-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine
SMILESCc1cc(/N=N/N(C(C)C)C(C)C)n[nH]1
InChIInChI=1S/C10H19N5/c1-7(2)15(8(3)4)14-13-10-6-9(5)11-12-10/h6-8H,1-5H3,(H,11,12)/b14-13+
InChIKeySSAXAAXODLOITE-BUHFOSPRSA-N
MW209.30 g/mol
LogP2.84
Rot. Bonds4

About N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine

N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine (PubChem CID 170459337) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine
PubChem CID170459337
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine
SMILESCc1cc(/N=N/N(C(C)C)C(C)C)n[nH]1
InChIInChI=1S/C10H19N5/c1-7(2)15(8(3)4)14-13-10-6-9(5)11-12-10/h6-8H,1-5H3,(H,11,12)/b14-13+
InChIKeySSAXAAXODLOITE-BUHFOSPRSA-N
XLogP2.84
TPSA56.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', '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-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine (CID 170459337) is N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine is Cc1cc(/N=N/N(C(C)C)C(C)C)n[nH]1.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is SSAXAAXODLOITE-BUHFOSPRSA-N. The full InChI is InChI=1S/C10H19N5/c1-7(2)15(8(3)4)14-13-10-6-9(5)11-12-10/h6-8H,1-5H3,(H,11,12)/b14-13+.
What are the key properties of N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine?
N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 209.30 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-3-yl)diazenyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 170459337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).