3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide

C17H29N3O3Si — CID 175243603

IUPAC3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide
SMILESCC(C)[Si](OCC(=O)c1cccnc1C(=O)NN)(C(C)C)C(C)C
InChIInChI=1S/C17H29N3O3Si/c1-11(2)24(12(3)4,13(5)6)23-10-15(21)14-8-7-9-19-16(14)17(22)20-18/h7-9,11-13H,10,18H2,1-6H3,(H,20,22)
InChIKeyUAJQVFLRFVVBSV-UHFFFAOYSA-N
MW351.52 g/mol
LogP3.06
Rot. Bonds8

About 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide

3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide (PubChem CID 175243603) has the molecular formula C17H29N3O3Si and a molecular weight of 351.52 g/mol. Its IUPAC name is 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide
PubChem CID175243603
Molecular FormulaC17H29N3O3Si
Molecular Weight351.52 g/mol
Exact Mass351.20
IUPAC Name3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide
SMILESCC(C)[Si](OCC(=O)c1cccnc1C(=O)NN)(C(C)C)C(C)C
InChIInChI=1S/C17H29N3O3Si/c1-11(2)24(12(3)4,13(5)6)23-10-15(21)14-8-7-9-19-16(14)17(22)20-18/h7-9,11-13H,10,18H2,1-6H3,(H,20,22)
InChIKeyUAJQVFLRFVVBSV-UHFFFAOYSA-N
XLogP3.06
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.52
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(hydrazinecarbonyl)-N-methylpyridine-2-carboxamide
CID 140772564
2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide
CID 177468032
3-hydroxypyridine-2-carbohydrazide
CID 45083058
2-(1-hydroxypropan-2-ylcarbamoyl)pyridine-3-carboxylic acid
CID 63614422
2-[[(2S)-1-methoxy-1-oxopropan-2-yl]carbamoyl]pyridine-3-carboxylic acid
CID 55249525
2-(2-propan-2-yloxyethylcarbamoyl)pyridine-3-carboxylic acid
CID 104759073
N-[1-(dimethylamino)propan-2-yl]-3-propanoylpyridine-2-carboxamide
CID 143839961
2-(2-methylpentan-3-ylcarbamoyl)pyridine-3-carboxylic acid
CID 55247596
2-[(2-methylpropan-2-yl)oxycarbamoyl]pyridine-3-carboxylic acid
CID 82720780
3-(2-aminoacetyl)-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 174414364
2-(ethoxycarbamoyl)pyridine-3-carboxylic acid
CID 64974014
2-(3-methylpentan-3-ylcarbamoyl)pyridine-3-carboxylic acid
CID 106328232

Frequently Asked Questions

What is the IUPAC name of 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide?
The IUPAC name of 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide (CID 175243603) is 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide?
The canonical SMILES for 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide is CC(C)[Si](OCC(=O)c1cccnc1C(=O)NN)(C(C)C)C(C)C.
What is the InChIKey of 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide?
The InChIKey is UAJQVFLRFVVBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O3Si/c1-11(2)24(12(3)4,13(5)6)23-10-15(21)14-8-7-9-19-16(14)17(22)20-18/h7-9,11-13H,10,18H2,1-6H3,(H,20,22).
What are the key properties of 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide?
3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide has a molecular weight of 351.52 g/mol, XLogP of 3.06, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-tri(propan-2-yl)silyloxyacetyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 175243603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).