N-(4-fluorophenyl)sulfanylindol-1-amine

C14H11FN2S — CID 145058406

IUPACN-(4-fluorophenyl)sulfanylindol-1-amine
SMILESFc1ccc(SNn2ccc3ccccc32)cc1
InChIInChI=1S/C14H11FN2S/c15-12-5-7-13(8-6-12)18-16-17-10-9-11-3-1-2-4-14(11)17/h1-10,16H
InChIKeyQJVQWDWUYRRFRS-UHFFFAOYSA-N
MW258.32 g/mol
LogP4.03
Rot. Bonds3

About N-(4-fluorophenyl)sulfanylindol-1-amine

N-(4-fluorophenyl)sulfanylindol-1-amine (PubChem CID 145058406) has the molecular formula C14H11FN2S and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(4-fluorophenyl)sulfanylindol-1-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)sulfanylindol-1-amine
PubChem CID145058406
Molecular FormulaC14H11FN2S
Molecular Weight258.32 g/mol
Exact Mass258.06
IUPAC NameN-(4-fluorophenyl)sulfanylindol-1-amine
SMILESFc1ccc(SNn2ccc3ccccc32)cc1
InChIInChI=1S/C14H11FN2S/c15-12-5-7-13(8-6-12)18-16-17-10-9-11-3-1-2-4-14(11)17/h1-10,16H
InChIKeyQJVQWDWUYRRFRS-UHFFFAOYSA-N
XLogP4.03
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(4-fluorophenyl)-3-indol-1-yl-N-methylpropan-1-amine
CID 58088567
ethane;1-(4-fluorophenyl)sulfanyl-2-methylindole
CID 145058268
N-pyridin-2-ylindol-1-amine
CID 22277752
1-(2-chloro-4-fluorophenyl)indole
CID 139914970
4-fluoro-N-(2-indol-1-ylethyl)benzenesulfonamide
CID 4625387
1-(1H-pyrazol-5-yl)indole
CID 23117277
(Z)-3-fluoro-N-(4-fluorophenyl)-3-indol-1-ylprop-2-enamide
CID 169095044
2-(3-fluorophenyl)-N-indol-1-ylpyrimidine-5-carboxamide
CID 25099313
(1Z)-1-[amino-[(4-fluorophenyl)sulfanylamino]methylidene]-2-naphthalen-1-ylguanidine
CID 176978190
2-fluoro-N-(2-indol-1-ylethyl)aniline
CID 62562125
1-N,4-N-bis[(4-fluorophenyl)sulfanyl]isoquinoline-1,4-diamine
CID 139570965
1-(4-fluorophenyl)sulfanylbenzotriazole
CID 26794753

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)sulfanylindol-1-amine?
The IUPAC name of N-(4-fluorophenyl)sulfanylindol-1-amine (CID 145058406) is N-(4-fluorophenyl)sulfanylindol-1-amine.
What is the SMILES notation for N-(4-fluorophenyl)sulfanylindol-1-amine?
The canonical SMILES for N-(4-fluorophenyl)sulfanylindol-1-amine is Fc1ccc(SNn2ccc3ccccc32)cc1.
What is the InChIKey of N-(4-fluorophenyl)sulfanylindol-1-amine?
The InChIKey is QJVQWDWUYRRFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2S/c15-12-5-7-13(8-6-12)18-16-17-10-9-11-3-1-2-4-14(11)17/h1-10,16H.
What are the key properties of N-(4-fluorophenyl)sulfanylindol-1-amine?
N-(4-fluorophenyl)sulfanylindol-1-amine has a molecular weight of 258.32 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)sulfanylindol-1-amine is sourced from PubChem (CID 145058406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).