(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

C14H16BrN3 — CID 63482059

IUPAC(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESCc1cc(Br)cc2c(NN)c3c(nc12)CCCC3
InChIInChI=1S/C14H16BrN3/c1-8-6-9(15)7-11-13(8)17-12-5-3-2-4-10(12)14(11)18-16/h6-7H,2-5,16H2,1H3,(H,17,18)
InChIKeyIFWJZVSAHFPGQW-UHFFFAOYSA-N
MW306.21 g/mol
LogP3.47
Rot. Bonds1

About (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (PubChem CID 63482059) has the molecular formula C14H16BrN3 and a molecular weight of 306.21 g/mol. Its IUPAC name is (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.

Molecular Properties

Compound Name(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
PubChem CID63482059
Molecular FormulaC14H16BrN3
Molecular Weight306.21 g/mol
Exact Mass305.05
IUPAC Name(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESCc1cc(Br)cc2c(NN)c3c(nc12)CCCC3
InChIInChI=1S/C14H16BrN3/c1-8-6-9(15)7-11-13(8)17-12-5-3-2-4-10(12)14(11)18-16/h6-7H,2-5,16H2,1H3,(H,17,18)
InChIKeyIFWJZVSAHFPGQW-UHFFFAOYSA-N
XLogP3.47
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.21
LogP ≤ 53.47
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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Frequently Asked Questions

What is the IUPAC name of (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The IUPAC name of (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (CID 63482059) is (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.
What is the SMILES notation for (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The canonical SMILES for (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is Cc1cc(Br)cc2c(NN)c3c(nc12)CCCC3.
What is the InChIKey of (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The InChIKey is IFWJZVSAHFPGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3/c1-8-6-9(15)7-11-13(8)17-12-5-3-2-4-10(12)14(11)18-16/h6-7H,2-5,16H2,1H3,(H,17,18).
What are the key properties of (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine has a molecular weight of 306.21 g/mol, XLogP of 3.47, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is sourced from PubChem (CID 63482059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).