4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide

C11H17N5O3 — CID 122386120

IUPAC4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide
SMILESCC(C)COc1cc(C(=O)NN)nc(C(=O)NN)c1
InChIInChI=1S/C11H17N5O3/c1-6(2)5-19-7-3-8(10(17)15-12)14-9(4-7)11(18)16-13/h3-4,6H,5,12-13H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyWTNDDHILBJOEDX-UHFFFAOYSA-N
MW267.29 g/mol
LogP-0.68
Rot. Bonds5

About 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide

4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide (PubChem CID 122386120) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide.

Molecular Properties

Compound Name4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide
PubChem CID122386120
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide
SMILESCC(C)COc1cc(C(=O)NN)nc(C(=O)NN)c1
InChIInChI=1S/C11H17N5O3/c1-6(2)5-19-7-3-8(10(17)15-12)14-9(4-7)11(18)16-13/h3-4,6H,5,12-13H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyWTNDDHILBJOEDX-UHFFFAOYSA-N
XLogP-0.68
TPSA132.36 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 5-0.68
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl N-[6-[[6-[[6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(2-methylpropoxy)-2-pyridinyl]carbamoyl]-4-(2-methylpropoxy)pyridine-2-carbonyl]amino]-4-(2-methylpropoxy)-2-pyridinyl]carbamate
CID 139250465
2-[4-(2-methylpropoxy)phenyl]-1,3-thiazole-4-carbohydrazide
CID 82515992
2-amino-4-methyl-6-[4-(2-methylpropoxy)phenyl]pyrimidine-5-carbohydrazide
CID 54851412
2,6-dimethyl-4-(2-methylpropoxy)benzoic acid
CID 59820032
4-(2-methylpropoxy)-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4937273
4-methyl-3-(2-methylpropoxy)benzohydrazide
CID 163359289
3-[4-(2-methylpropoxy)phenyl]propanehydrazide
CID 164513636
methyl 2-[4-(2-methylpropoxy)phenyl]propanoate
CID 135079153
dimethyl 4-ethoxypyridine-2,6-dicarboxylate
CID 73212602
2-(aminomethyl)-N-[3-(2-methylpropoxy)phenyl]-1,3-thiazole-4-carboxamide
CID 66377258
3-ethoxycarbonyl-5-(2-methylpropoxy)benzoic acid
CID 67305199
2-(aminomethyl)-N-[3-(2-methylpropoxy)phenyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119714907

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide?
The IUPAC name of 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide (CID 122386120) is 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide.
What is the SMILES notation for 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide?
The canonical SMILES for 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide is CC(C)COc1cc(C(=O)NN)nc(C(=O)NN)c1.
What is the InChIKey of 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide?
The InChIKey is WTNDDHILBJOEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3/c1-6(2)5-19-7-3-8(10(17)15-12)14-9(4-7)11(18)16-13/h3-4,6H,5,12-13H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide?
4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide has a molecular weight of 267.29 g/mol, XLogP of -0.68, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxy)pyridine-2,6-dicarbohydrazide is sourced from PubChem (CID 122386120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).