N-dimethylindiganyl-4-fluoroaniline

C8H11FInN — CID 139798759

IUPACN-dimethylindiganyl-4-fluoroaniline
SMILESC[In](C)Nc1ccc(F)cc1
InChIInChI=1S/C6H5FN.2CH3.In/c7-5-1-3-6(8)4-2-5;;;/h1-4,8H;2*1H3;/q-1;;;+1
InChIKeySFZQQJCJQTXUJH-UHFFFAOYSA-N
MW255.00 g/mol
LogP2.49
Rot. Bonds2

About N-dimethylindiganyl-4-fluoroaniline

N-dimethylindiganyl-4-fluoroaniline (PubChem CID 139798759) has the molecular formula C8H11FInN and a molecular weight of 255.00 g/mol. Its IUPAC name is N-dimethylindiganyl-4-fluoroaniline.

Molecular Properties

Compound NameN-dimethylindiganyl-4-fluoroaniline
PubChem CID139798759
Molecular FormulaC8H11FInN
Molecular Weight255.00 g/mol
Exact Mass254.99
IUPAC NameN-dimethylindiganyl-4-fluoroaniline
SMILESC[In](C)Nc1ccc(F)cc1
InChIInChI=1S/C6H5FN.2CH3.In/c7-5-1-3-6(8)4-2-5;;;/h1-4,8H;2*1H3;/q-1;;;+1
InChIKeySFZQQJCJQTXUJH-UHFFFAOYSA-N
XLogP2.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.00
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-N-propan-2-yl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-amine
CID 169440641
chloromethane;(4-fluorophenyl)hydrazine
CID 158547421
4-N-(4-fluorophenyl)-1-N-methylbenzene-1,4-diamine
CID 101413906
N-[1-(2,4-difluorophenyl)ethyl]-4-fluoroaniline
CID 43194675
4-fluoro-N-(methylaminosulfanyl)aniline
CID 145139879
(4-fluorophenyl)hydrazine;hydrate
CID 19886243
N-bis(4-fluoroanilino)boranyl-4-fluoroaniline
CID 139173825
1-N,3-N,5-N-tris(4-fluorophenyl)benzene-1,3,5-triamine
CID 14762541
1,4-difluorobenzene bromide
CID 21301175
4-fluoro-N-pentan-2-ylaniline
CID 15724808
4-fluoro-N-(methoxymethyl)aniline
CID 14532460
N-[1-(4-fluorophenyl)ethyl]-4-methylaniline
CID 43179245

Frequently Asked Questions

What is the IUPAC name of N-dimethylindiganyl-4-fluoroaniline?
The IUPAC name of N-dimethylindiganyl-4-fluoroaniline (CID 139798759) is N-dimethylindiganyl-4-fluoroaniline.
What is the SMILES notation for N-dimethylindiganyl-4-fluoroaniline?
The canonical SMILES for N-dimethylindiganyl-4-fluoroaniline is C[In](C)Nc1ccc(F)cc1.
What is the InChIKey of N-dimethylindiganyl-4-fluoroaniline?
The InChIKey is SFZQQJCJQTXUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FN.2CH3.In/c7-5-1-3-6(8)4-2-5;;;/h1-4,8H;2*1H3;/q-1;;;+1.
What are the key properties of N-dimethylindiganyl-4-fluoroaniline?
N-dimethylindiganyl-4-fluoroaniline has a molecular weight of 255.00 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethylindiganyl-4-fluoroaniline is sourced from PubChem (CID 139798759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).