3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide

C11H18N4O2 — CID 105071982

IUPAC3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide
SMILESCC(C)N(CCO)C(=O)c1ccncc1NN
InChIInChI=1S/C11H18N4O2/c1-8(2)15(5-6-16)11(17)9-3-4-13-7-10(9)14-12/h3-4,7-8,14,16H,5-6,12H2,1-2H3
InChIKeyBWDWIOLNBWISFI-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.21
Rot. Bonds5

About 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide

3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide (PubChem CID 105071982) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide
PubChem CID105071982
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide
SMILESCC(C)N(CCO)C(=O)c1ccncc1NN
InChIInChI=1S/C11H18N4O2/c1-8(2)15(5-6-16)11(17)9-3-4-13-7-10(9)14-12/h3-4,7-8,14,16H,5-6,12H2,1-2H3
InChIKeyBWDWIOLNBWISFI-UHFFFAOYSA-N
XLogP0.21
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.21
H-Bond Donors ≤ 53
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 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide?
The IUPAC name of 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide (CID 105071982) is 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide.
What is the SMILES notation for 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide?
The canonical SMILES for 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide is CC(C)N(CCO)C(=O)c1ccncc1NN.
What is the InChIKey of 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide?
The InChIKey is BWDWIOLNBWISFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8(2)15(5-6-16)11(17)9-3-4-13-7-10(9)14-12/h3-4,7-8,14,16H,5-6,12H2,1-2H3.
What are the key properties of 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide?
3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.21, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-4-carboxamide is sourced from PubChem (CID 105071982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).