[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine

C15H20N4 — CID 105320295

IUPAC[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine
SMILESC=C(CC)CC(NN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H20N4/c1-3-12(2)9-15(18-16)13-10-17-19(11-13)14-7-5-4-6-8-14/h4-8,10-11,15,18H,2-3,9,16H2,1H3
InChIKeyHMYYTRJPOVNODE-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.73
Rot. Bonds6

About [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine

[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine (PubChem CID 105320295) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine
PubChem CID105320295
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine
SMILESC=C(CC)CC(NN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H20N4/c1-3-12(2)9-15(18-16)13-10-17-19(11-13)14-7-5-4-6-8-14/h4-8,10-11,15,18H,2-3,9,16H2,1H3
InChIKeyHMYYTRJPOVNODE-UHFFFAOYSA-N
XLogP2.73
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3-methylidene-1-phenylpentyl)hydrazine
CID 105199375
[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine
CID 105298119
[1-(1-phenylpyrazol-4-yl)-2-propan-2-yloxyethyl]hydrazine
CID 105323696
[2-(1-methylpyrazol-3-yl)-1-(1-phenylpyrazol-4-yl)ethyl]hydrazine
CID 105329489
1-(1-phenylpyrazol-4-yl)ethylhydrazine
CID 81470645
3-(methylamino)-3-(1-phenylpyrazol-4-yl)propanoic acid
CID 65236429
[2-(1-methylimidazol-2-yl)-1-(1-phenylpyrazol-4-yl)ethyl]hydrazine
CID 105322893
(3S)-3-acetamido-3-(1-phenylpyrazol-4-yl)propanoic acid
CID 63650204
2-methyl-1-(1-phenylpyrazol-4-yl)prop-2-en-1-amine
CID 105163593
2-[1-(1-phenylpyrazol-4-yl)ethylamino]ethanol
CID 81302041
N-ethyl-2-methoxy-1-(1-phenylpyrazol-4-yl)ethanamine
CID 105165630
2-[1-(1-phenylpyrazol-4-yl)ethylamino]acetamide
CID 81470640

Frequently Asked Questions

What is the IUPAC name of [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine?
The IUPAC name of [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine (CID 105320295) is [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine.
What is the SMILES notation for [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine?
The canonical SMILES for [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine is C=C(CC)CC(NN)c1cnn(-c2ccccc2)c1.
What is the InChIKey of [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine?
The InChIKey is HMYYTRJPOVNODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-3-12(2)9-15(18-16)13-10-17-19(11-13)14-7-5-4-6-8-14/h4-8,10-11,15,18H,2-3,9,16H2,1H3.
What are the key properties of [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine?
[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine has a molecular weight of 256.35 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine is sourced from PubChem (CID 105320295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).