[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine

C16H22BrN3 — CID 105257345

IUPAC[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine
SMILESCCC(CC)CC(NN)c1nc2ccccc2cc1Br
InChIInChI=1S/C16H22BrN3/c1-3-11(4-2)9-15(20-18)16-13(17)10-12-7-5-6-8-14(12)19-16/h5-8,10-11,15,20H,3-4,9,18H2,1-2H3
InChIKeyFNHDRPMMVRPHCL-UHFFFAOYSA-N
MW336.28 g/mol
LogP4.33
Rot. Bonds6

About [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine

[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine (PubChem CID 105257345) has the molecular formula C16H22BrN3 and a molecular weight of 336.28 g/mol. Its IUPAC name is [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine
PubChem CID105257345
Molecular FormulaC16H22BrN3
Molecular Weight336.28 g/mol
Exact Mass335.10
IUPAC Name[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine
SMILESCCC(CC)CC(NN)c1nc2ccccc2cc1Br
InChIInChI=1S/C16H22BrN3/c1-3-11(4-2)9-15(20-18)16-13(17)10-12-7-5-6-8-14(12)19-16/h5-8,10-11,15,20H,3-4,9,18H2,1-2H3
InChIKeyFNHDRPMMVRPHCL-UHFFFAOYSA-N
XLogP4.33
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.28
LogP ≤ 54.33
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'}

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Related Compounds

1-(3-bromoquinolin-2-yl)-N,3-diethylpentan-1-amine
CID 82909949
1-(3-bromoquinolin-2-yl)heptylhydrazine
CID 105257321
[1-(3-bromoquinolin-2-yl)-2-methylpropyl]hydrazine
CID 105257290
[1-(3-bromoquinolin-2-yl)-2-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105257250
[1-(3-bromoquinolin-2-yl)-3-methylbut-2-enyl]hydrazine
CID 105257346
1-(3-bromoquinolin-2-yl)-N-ethyl-4-methoxybutan-1-amine
CID 114856703
1-(3-bromoquinolin-2-yl)-2-methylpentan-1-ol
CID 114013472
[(3-bromoquinolin-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105257271
(3-ethyl-1-pyridin-2-ylpentyl)hydrazine
CID 105195992
[1-(5-bromo-2-fluorophenyl)-3-ethylpentyl]hydrazine
CID 105280759
(3-bromoquinolin-2-yl)-(3-propyltriazol-4-yl)methanamine
CID 114688819
(3-ethyl-1-pyrimidin-2-ylpentyl)hydrazine
CID 105203815

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine?
The IUPAC name of [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine (CID 105257345) is [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine.
What is the SMILES notation for [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine?
The canonical SMILES for [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine is CCC(CC)CC(NN)c1nc2ccccc2cc1Br.
What is the InChIKey of [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine?
The InChIKey is FNHDRPMMVRPHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22BrN3/c1-3-11(4-2)9-15(20-18)16-13(17)10-12-7-5-6-8-14(12)19-16/h5-8,10-11,15,20H,3-4,9,18H2,1-2H3.
What are the key properties of [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine?
[1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine has a molecular weight of 336.28 g/mol, XLogP of 4.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromoquinolin-2-yl)-3-ethylpentyl]hydrazine is sourced from PubChem (CID 105257345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).