N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine

C14H16N2O2 — CID 21192892

IUPACN-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine
SMILESCOc1ccc2nc3c(c(NO)c2c1)CCCC3
InChIInChI=1S/C14H16N2O2/c1-18-9-6-7-13-11(8-9)14(16-17)10-4-2-3-5-12(10)15-13/h6-8,17H,2-5H2,1H3,(H,15,16)
InChIKeyHFTWYUVYXCUREZ-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.92
Rot. Bonds2

About N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine

N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine (PubChem CID 21192892) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine.

Molecular Properties

Compound NameN-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine
PubChem CID21192892
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine
SMILESCOc1ccc2nc3c(c(NO)c2c1)CCCC3
InChIInChI=1S/C14H16N2O2/c1-18-9-6-7-13-11(8-9)14(16-17)10-4-2-3-5-12(10)15-13/h6-8,17H,2-5H2,1H3,(H,15,16)
InChIKeyHFTWYUVYXCUREZ-UHFFFAOYSA-N
XLogP2.92
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine?
The IUPAC name of N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine (CID 21192892) is N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine.
What is the SMILES notation for N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine?
The canonical SMILES for N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine is COc1ccc2nc3c(c(NO)c2c1)CCCC3.
What is the InChIKey of N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine?
The InChIKey is HFTWYUVYXCUREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-18-9-6-7-13-11(8-9)14(16-17)10-4-2-3-5-12(10)15-13/h6-8,17H,2-5H2,1H3,(H,15,16).
What are the key properties of N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine?
N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine has a molecular weight of 244.29 g/mol, XLogP of 2.92, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine is sourced from PubChem (CID 21192892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).