1-(1-phenylcyclopropyl)prop-2-ynylhydrazine

C12H14N2 — CID 105217097

IUPAC1-(1-phenylcyclopropyl)prop-2-ynylhydrazine
SMILESC#CC(NN)C1(c2ccccc2)CC1
InChIInChI=1S/C12H14N2/c1-2-11(14-13)12(8-9-12)10-6-4-3-5-7-10/h1,3-7,11,14H,8-9,13H2
InChIKeyWOQZXAAATFSBIH-UHFFFAOYSA-N
MW186.26 g/mol
LogP1.18
Rot. Bonds3

About 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine

1-(1-phenylcyclopropyl)prop-2-ynylhydrazine (PubChem CID 105217097) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine.

Molecular Properties

Compound Name1-(1-phenylcyclopropyl)prop-2-ynylhydrazine
PubChem CID105217097
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name1-(1-phenylcyclopropyl)prop-2-ynylhydrazine
SMILESC#CC(NN)C1(c2ccccc2)CC1
InChIInChI=1S/C12H14N2/c1-2-11(14-13)12(8-9-12)10-6-4-3-5-7-10/h1,3-7,11,14H,8-9,13H2
InChIKeyWOQZXAAATFSBIH-UHFFFAOYSA-N
XLogP1.18
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(1-phenylcyclopropyl)pent-4-ynylhydrazine
CID 105217111
[(1-phenylcyclopropyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105217227
[(2-methylphenyl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217005
[(2,6-difluorophenyl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217060
1-(1-phenylcyclobutyl)hex-5-ynylhydrazine
CID 105217339
[cyclopentyl-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217048
[3-methyl-1-(1-phenylcyclopropyl)butyl]hydrazine
CID 105217001
[(3-bromofuran-2-yl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217228
[1-benzofuran-2-yl-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217239
[(2-methylpyrazol-3-yl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217018
[(4-methylphenyl)-(1-phenylcyclopentyl)methyl]hydrazine
CID 105217438
[(4-methyl-3-pyridinyl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217138

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine?
The IUPAC name of 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine (CID 105217097) is 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine.
What is the SMILES notation for 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine?
The canonical SMILES for 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine is C#CC(NN)C1(c2ccccc2)CC1.
What is the InChIKey of 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine?
The InChIKey is WOQZXAAATFSBIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-2-11(14-13)12(8-9-12)10-6-4-3-5-7-10/h1,3-7,11,14H,8-9,13H2.
What are the key properties of 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine?
1-(1-phenylcyclopropyl)prop-2-ynylhydrazine has a molecular weight of 186.26 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclopropyl)prop-2-ynylhydrazine is sourced from PubChem (CID 105217097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).