N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide

C17H19FN2O — CID 15157948

IUPACN-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide
SMILESCCCC(=O)Nc1c2c(nc3cc(F)ccc13)CCCC2
InChIInChI=1S/C17H19FN2O/c1-2-5-16(21)20-17-12-6-3-4-7-14(12)19-15-10-11(18)8-9-13(15)17/h8-10H,2-7H2,1H3,(H,19,20,21)
InChIKeyFEVXBERIPHEUGQ-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.99
Rot. Bonds3

About N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide

N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide (PubChem CID 15157948) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide.

Molecular Properties

Compound NameN-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide
PubChem CID15157948
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC NameN-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide
SMILESCCCC(=O)Nc1c2c(nc3cc(F)ccc13)CCCC2
InChIInChI=1S/C17H19FN2O/c1-2-5-16(21)20-17-12-6-3-4-7-14(12)19-15-10-11(18)8-9-13(15)17/h8-10H,2-7H2,1H3,(H,19,20,21)
InChIKeyFEVXBERIPHEUGQ-UHFFFAOYSA-N
XLogP3.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Tacrine
CID 1935
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine
CID 7019
9-Aminoacridine hydrochloride
CID 8643
4-Amino-2-methylquinoline
CID 81116
1-Acridinamine
CID 11352
1,2,3,4-Tetrahydro-9-acridinamine hydrochloride hydrate (1:?:?)
CID 6420002
9-Aminoacridine hydrochloride monohydrate
CID 2723598
Acetanilide, 4'-(9-acridinylamino)-
CID 47508
N-Methyl-9-acridinamine
CID 31503
N-Phenyl-9-acridinamine
CID 18757
N4-9-Acridinyl-N1,N1-dimethyl-1,4-benzenediamine
CID 25926

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The IUPAC name of N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide (CID 15157948) is N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide.
What is the SMILES notation for N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The canonical SMILES for N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide is CCCC(=O)Nc1c2c(nc3cc(F)ccc13)CCCC2.
What is the InChIKey of N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The InChIKey is FEVXBERIPHEUGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-2-5-16(21)20-17-12-6-3-4-7-14(12)19-15-10-11(18)8-9-13(15)17/h8-10H,2-7H2,1H3,(H,19,20,21).
What are the key properties of N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide?
N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide has a molecular weight of 286.35 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)butanamide is sourced from PubChem (CID 15157948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).