2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide

C16H25N3O — CID 103503815

IUPAC2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide
SMILESCC(C)C1CCN(C(C(=O)NN)c2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-12(2)13-8-10-19(11-9-13)15(16(20)18-17)14-6-4-3-5-7-14/h3-7,12-13,15H,8-11,17H2,1-2H3,(H,18,20)
InChIKeyMJZHJTBSFURRJE-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.09
Rot. Bonds4

About 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide

2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide (PubChem CID 103503815) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide.

Molecular Properties

Compound Name2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide
PubChem CID103503815
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide
SMILESCC(C)C1CCN(C(C(=O)NN)c2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-12(2)13-8-10-19(11-9-13)15(16(20)18-17)14-6-4-3-5-7-14/h3-7,12-13,15H,8-11,17H2,1-2H3,(H,18,20)
InChIKeyMJZHJTBSFURRJE-UHFFFAOYSA-N
XLogP2.09
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide?
The IUPAC name of 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide (CID 103503815) is 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide.
What is the SMILES notation for 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide?
The canonical SMILES for 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide is CC(C)C1CCN(C(C(=O)NN)c2ccccc2)CC1.
What is the InChIKey of 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide?
The InChIKey is MJZHJTBSFURRJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-12(2)13-8-10-19(11-9-13)15(16(20)18-17)14-6-4-3-5-7-14/h3-7,12-13,15H,8-11,17H2,1-2H3,(H,18,20).
What are the key properties of 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide?
2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide has a molecular weight of 275.40 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(4-propan-2-ylpiperidin-1-yl)acetohydrazide is sourced from PubChem (CID 103503815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).