1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine

C10H18N2 — CID 90828841

IUPAC1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine
SMILESCCC(CC)NNC1=CCC=C1
InChIInChI=1S/C10H18N2/c1-3-9(4-2)11-12-10-7-5-6-8-10/h5,7-9,11-12H,3-4,6H2,1-2H3
InChIKeyDJHFOPKPXHSLAV-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.11
Rot. Bonds5

About 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine

1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine (PubChem CID 90828841) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine.

Molecular Properties

Compound Name1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine
PubChem CID90828841
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine
SMILESCCC(CC)NNC1=CCC=C1
InChIInChI=1S/C10H18N2/c1-3-9(4-2)11-12-10-7-5-6-8-10/h5,7-9,11-12H,3-4,6H2,1-2H3
InChIKeyDJHFOPKPXHSLAV-UHFFFAOYSA-N
XLogP2.11
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Pyrazole, dihydro-3,5-dimethyl-
CID 4867585
Cyclopenta-2,4-dien-1-ylhydrazine
CID 15254470
3-ethenyl-5-methyl-2,3-dihydro-1H-pyrazole
CID 67790953
5-ethyl-2,3-dihydro-1H-pyrazole
CID 70535941
3,5-di(cyclohexa-1,5-dien-1-yl)-2,3-dihydro-1H-pyrazole
CID 117991358
[(3S)-5-methyl-2,3-dihydro-1H-pyrazol-3-yl]methanamine
CID 122691908
3-tert-butyl-5-methyl-2-[(2Z,4E,6Z)-octa-2,4,6-trien-4-yl]-1,5-dihydropyrazole
CID 126727632
(4E)-3-(2-methylhydrazinyl)hexa-1,4-dien-2-amine
CID 126733958
1-[(4Z,6Z)-6-ethylocta-4,6-dien-2-yl]-2-[(E)-pent-2-en-3-yl]hydrazine
CID 129292090
3,5-diethyl-2,3-dihydro-1H-pyrazole
CID 130328755
1-methyl-2-[(3E)-2-methylhexa-3,5-dien-3-yl]hydrazine
CID 130340171
(3-methyl-2,3-dihydro-1H-pyrazol-5-yl)methanamine
CID 134243555

Frequently Asked Questions

What is the IUPAC name of 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine?
The IUPAC name of 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine (CID 90828841) is 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine.
What is the SMILES notation for 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine?
The canonical SMILES for 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine is CCC(CC)NNC1=CCC=C1.
What is the InChIKey of 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine?
The InChIKey is DJHFOPKPXHSLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-3-9(4-2)11-12-10-7-5-6-8-10/h5,7-9,11-12H,3-4,6H2,1-2H3.
What are the key properties of 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine?
1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine has a molecular weight of 166.27 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopenta-1,4-dien-1-yl-2-pentan-3-ylhydrazine is sourced from PubChem (CID 90828841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).