1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide

C7H15N5O — CID 126972262

IUPAC1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide
SMILESN/N=C(\N)N1CCCC(C(N)=O)C1
InChIInChI=1S/C7H15N5O/c8-6(13)5-2-1-3-12(4-5)7(9)11-10/h5H,1-4,10H2,(H2,8,13)(H2,9,11)
InChIKeyRQKBWJUOXOIMED-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.63
Rot. Bonds1

About 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide

1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide (PubChem CID 126972262) has the molecular formula C7H15N5O and a molecular weight of 185.23 g/mol. Its IUPAC name is 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide
PubChem CID126972262
Molecular FormulaC7H15N5O
Molecular Weight185.23 g/mol
Exact Mass185.13
IUPAC Name1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide
SMILESN/N=C(\N)N1CCCC(C(N)=O)C1
InChIInChI=1S/C7H15N5O/c8-6(13)5-2-1-3-12(4-5)7(9)11-10/h5H,1-4,10H2,(H2,8,13)(H2,9,11)
InChIKeyRQKBWJUOXOIMED-UHFFFAOYSA-N
XLogP-1.63
TPSA110.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide?
The IUPAC name of 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide (CID 126972262) is 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide is N/N=C(\N)N1CCCC(C(N)=O)C1.
What is the InChIKey of 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide?
The InChIKey is RQKBWJUOXOIMED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5O/c8-6(13)5-2-1-3-12(4-5)7(9)11-10/h5H,1-4,10H2,(H2,8,13)(H2,9,11).
What are the key properties of 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide?
1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide has a molecular weight of 185.23 g/mol, XLogP of -1.63, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide is sourced from PubChem (CID 126972262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).