5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine

C18H15FN2 — CID 116531900

IUPAC5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine
SMILESNC1(c2cccc3ncccc23)CCc2cc(F)ccc21
InChIInChI=1S/C18H15FN2/c19-13-6-7-15-12(11-13)8-9-18(15,20)16-4-1-5-17-14(16)3-2-10-21-17/h1-7,10-11H,8-9,20H2
InChIKeyZZDMKWQBVDYGTF-UHFFFAOYSA-N
MW278.33 g/mol
LogP3.52
Rot. Bonds1

About 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine

5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine (PubChem CID 116531900) has the molecular formula C18H15FN2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine.

Molecular Properties

Compound Name5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine
PubChem CID116531900
Molecular FormulaC18H15FN2
Molecular Weight278.33 g/mol
Exact Mass278.12
IUPAC Name5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine
SMILESNC1(c2cccc3ncccc23)CCc2cc(F)ccc21
InChIInChI=1S/C18H15FN2/c19-13-6-7-15-12(11-13)8-9-18(15,20)16-4-1-5-17-14(16)3-2-10-21-17/h1-7,10-11H,8-9,20H2
InChIKeyZZDMKWQBVDYGTF-UHFFFAOYSA-N
XLogP3.52
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-1-quinolin-7-yl-2,3-dihydroinden-1-amine
CID 116532073
1-(2,4-difluorophenyl)-2,3-dihydroinden-1-amine
CID 55120511
5-fluoro-1-(2,4,5-trimethylphenyl)-2,3-dihydroinden-1-amine
CID 116532005
1-(3,4-dichlorophenyl)-5-fluoro-2,3-dihydroinden-1-amine
CID 116531885
1-(2,4-dimethylphenyl)-5-fluoro-2,3-dihydroinden-1-amine
CID 116531960
1-quinolin-5-yl-2,3-dihydroinden-1-ol
CID 81196770
1-(4-bromothiophen-3-yl)-5-fluoro-2,3-dihydroinden-1-amine
CID 116532011
5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine
CID 116532007
2-quinolin-5-yl-3,4-dihydro-1H-naphthalen-2-ol
CID 81196643
5-fluoro-1-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydroinden-1-amine
CID 116531567
3,5-dimethyl-1-quinolin-5-ylcyclohexan-1-amine
CID 81216239
(2-chloro-5-fluorophenyl)-quinolin-5-ylmethanamine
CID 105396959

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine?
The IUPAC name of 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine (CID 116531900) is 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine.
What is the SMILES notation for 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine?
The canonical SMILES for 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine is NC1(c2cccc3ncccc23)CCc2cc(F)ccc21.
What is the InChIKey of 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine?
The InChIKey is ZZDMKWQBVDYGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2/c19-13-6-7-15-12(11-13)8-9-18(15,20)16-4-1-5-17-14(16)3-2-10-21-17/h1-7,10-11H,8-9,20H2.
What are the key properties of 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine?
5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine has a molecular weight of 278.33 g/mol, XLogP of 3.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-quinolin-5-yl-2,3-dihydroinden-1-amine is sourced from PubChem (CID 116531900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).