1-quinolin-2-ylpent-3-ynylhydrazine

C14H15N3 — CID 105218650

IUPAC1-quinolin-2-ylpent-3-ynylhydrazine
SMILESCC#CCC(NN)c1ccc2ccccc2n1
InChIInChI=1S/C14H15N3/c1-2-3-7-14(17-15)13-10-9-11-6-4-5-8-12(11)16-13/h4-6,8-10,14,17H,7,15H2,1H3
InChIKeyHMKHSVPAMVFYRC-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.15
Rot. Bonds3

About 1-quinolin-2-ylpent-3-ynylhydrazine

1-quinolin-2-ylpent-3-ynylhydrazine (PubChem CID 105218650) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is 1-quinolin-2-ylpent-3-ynylhydrazine.

Molecular Properties

Compound Name1-quinolin-2-ylpent-3-ynylhydrazine
PubChem CID105218650
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC Name1-quinolin-2-ylpent-3-ynylhydrazine
SMILESCC#CCC(NN)c1ccc2ccccc2n1
InChIInChI=1S/C14H15N3/c1-2-3-7-14(17-15)13-10-9-11-6-4-5-8-12(11)16-13/h4-6,8-10,14,17H,7,15H2,1H3
InChIKeyHMKHSVPAMVFYRC-UHFFFAOYSA-N
XLogP2.15
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of 1-quinolin-2-ylpent-3-ynylhydrazine?
The IUPAC name of 1-quinolin-2-ylpent-3-ynylhydrazine (CID 105218650) is 1-quinolin-2-ylpent-3-ynylhydrazine.
What is the SMILES notation for 1-quinolin-2-ylpent-3-ynylhydrazine?
The canonical SMILES for 1-quinolin-2-ylpent-3-ynylhydrazine is CC#CCC(NN)c1ccc2ccccc2n1.
What is the InChIKey of 1-quinolin-2-ylpent-3-ynylhydrazine?
The InChIKey is HMKHSVPAMVFYRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c1-2-3-7-14(17-15)13-10-9-11-6-4-5-8-12(11)16-13/h4-6,8-10,14,17H,7,15H2,1H3.
What are the key properties of 1-quinolin-2-ylpent-3-ynylhydrazine?
1-quinolin-2-ylpent-3-ynylhydrazine has a molecular weight of 225.30 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-2-ylpent-3-ynylhydrazine is sourced from PubChem (CID 105218650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).