(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide

C9H17N3O — CID 134458222

IUPAC(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide
SMILESC/C=C\C=C(/NN)C(=O)NC(C)C
InChIInChI=1S/C9H17N3O/c1-4-5-6-8(12-10)9(13)11-7(2)3/h4-7,12H,10H2,1-3H3,(H,11,13)/b5-4-,8-6-
InChIKeyBMMQYHHAZMKJJX-NADLECRISA-N
MW183.25 g/mol
LogP0.43
Rot. Bonds4

About (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide

(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide (PubChem CID 134458222) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide.

Molecular Properties

Compound Name(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide
PubChem CID134458222
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide
SMILESC/C=C\C=C(/NN)C(=O)NC(C)C
InChIInChI=1S/C9H17N3O/c1-4-5-6-8(12-10)9(13)11-7(2)3/h4-7,12H,10H2,1-3H3,(H,11,13)/b5-4-,8-6-
InChIKeyBMMQYHHAZMKJJX-NADLECRISA-N
XLogP0.43
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide?
The IUPAC name of (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide (CID 134458222) is (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide.
What is the SMILES notation for (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide?
The canonical SMILES for (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide is C/C=C\C=C(/NN)C(=O)NC(C)C.
What is the InChIKey of (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide?
The InChIKey is BMMQYHHAZMKJJX-NADLECRISA-N. The full InChI is InChI=1S/C9H17N3O/c1-4-5-6-8(12-10)9(13)11-7(2)3/h4-7,12H,10H2,1-3H3,(H,11,13)/b5-4-,8-6-.
What are the key properties of (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide?
(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide has a molecular weight of 183.25 g/mol, XLogP of 0.43, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide is sourced from PubChem (CID 134458222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).