[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine

C13H13N5 — CID 62244078

IUPAC[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine
SMILESNNc1nc2ccccc2cc1Cn1ccnc1
InChIInChI=1S/C13H13N5/c14-17-13-11(8-18-6-5-15-9-18)7-10-3-1-2-4-12(10)16-13/h1-7,9H,8,14H2,(H,16,17)
InChIKeyYPUIXHWHGZVNGL-UHFFFAOYSA-N
MW239.28 g/mol
LogP1.77
Rot. Bonds3

About [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine

[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine (PubChem CID 62244078) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine
PubChem CID62244078
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine
SMILESNNc1nc2ccccc2cc1Cn1ccnc1
InChIInChI=1S/C13H13N5/c14-17-13-11(8-18-6-5-15-9-18)7-10-3-1-2-4-12(10)16-13/h1-7,9H,8,14H2,(H,16,17)
InChIKeyYPUIXHWHGZVNGL-UHFFFAOYSA-N
XLogP1.77
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[3-(azepan-1-ylmethyl)quinolin-2-yl]hydrazine
CID 62244240
[3-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]quinolin-2-yl]hydrazine
CID 62244092
[3-[(2-ethylimidazol-1-yl)methyl]quinolin-2-yl]hydrazine
CID 62244455
[3-[(3,4-dimethylpyrrolidin-1-yl)methyl]quinolin-2-yl]hydrazine
CID 79184116
1-[(2-hydrazinylquinolin-3-yl)methyl]-1,2,4-triazole-3-carbonitrile
CID 62949579
3-(3-imidazol-1-ylpropyl)quinolin-2-amine
CID 67942243
[3-[(4-methylpiperidin-1-yl)methyl]quinolin-2-yl]hydrazine
CID 62246122
(2-imidazol-1-ylquinolin-3-yl)methanamine
CID 28965406
[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine
CID 62245796
[3-(1H-imidazol-2-ylsulfanylmethyl)quinolin-2-yl]hydrazine
CID 107782372
[3-[(3,3-dimethylmorpholin-4-yl)methyl]quinolin-2-yl]hydrazine
CID 62244968
1-[(1-methylnaphthalen-2-yl)methyl]imidazole
CID 172812085

Frequently Asked Questions

What is the IUPAC name of [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine?
The IUPAC name of [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine (CID 62244078) is [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine.
What is the SMILES notation for [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine?
The canonical SMILES for [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine is NNc1nc2ccccc2cc1Cn1ccnc1.
What is the InChIKey of [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine?
The InChIKey is YPUIXHWHGZVNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c14-17-13-11(8-18-6-5-15-9-18)7-10-3-1-2-4-12(10)16-13/h1-7,9H,8,14H2,(H,16,17).
What are the key properties of [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine?
[3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine has a molecular weight of 239.28 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(imidazol-1-ylmethyl)quinolin-2-yl]hydrazine is sourced from PubChem (CID 62244078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).