6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine

C17H21FN2 — CID 103996222

IUPAC6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCCNc1c2c(nc3cc(F)c(C)cc13)CCCC2
InChIInChI=1S/C17H21FN2/c1-3-8-19-17-12-6-4-5-7-15(12)20-16-10-14(18)11(2)9-13(16)17/h9-10H,3-8H2,1-2H3,(H,19,20)
InChIKeyKJQLAMHCBMEBAR-UHFFFAOYSA-N
MW272.37 g/mol
LogP4.38
Rot. Bonds3

About 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine

6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 103996222) has the molecular formula C17H21FN2 and a molecular weight of 272.37 g/mol. Its IUPAC name is 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID103996222
Molecular FormulaC17H21FN2
Molecular Weight272.37 g/mol
Exact Mass272.17
IUPAC Name6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCCNc1c2c(nc3cc(F)c(C)cc13)CCCC2
InChIInChI=1S/C17H21FN2/c1-3-8-19-17-12-6-4-5-7-15(12)20-16-10-14(18)11(2)9-13(16)17/h9-10H,3-8H2,1-2H3,(H,19,20)
InChIKeyKJQLAMHCBMEBAR-UHFFFAOYSA-N
XLogP4.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine (CID 103996222) is 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine is CCCNc1c2c(nc3cc(F)c(C)cc13)CCCC2.
What is the InChIKey of 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is KJQLAMHCBMEBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2/c1-3-8-19-17-12-6-4-5-7-15(12)20-16-10-14(18)11(2)9-13(16)17/h9-10H,3-8H2,1-2H3,(H,19,20).
What are the key properties of 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 272.37 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 103996222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).