2-fluoro-N,6-dimethylaniline;hydrochloride

C8H11ClFN — CID 167737520

IUPAC2-fluoro-N,6-dimethylaniline;hydrochloride
SMILESCNc1c(C)cccc1F.Cl
InChIInChI=1S/C8H10FN.ClH/c1-6-4-3-5-7(9)8(6)10-2;/h3-5,10H,1-2H3;1H
InChIKeyFQLWWRBKAIAYPW-UHFFFAOYSA-N
MW175.63 g/mol
LogP2.60
Rot. Bonds1

About 2-fluoro-N,6-dimethylaniline;hydrochloride

2-fluoro-N,6-dimethylaniline;hydrochloride (PubChem CID 167737520) has the molecular formula C8H11ClFN and a molecular weight of 175.63 g/mol. Its IUPAC name is 2-fluoro-N,6-dimethylaniline;hydrochloride.

Molecular Properties

Compound Name2-fluoro-N,6-dimethylaniline;hydrochloride
PubChem CID167737520
Molecular FormulaC8H11ClFN
Molecular Weight175.63 g/mol
Exact Mass175.06
IUPAC Name2-fluoro-N,6-dimethylaniline;hydrochloride
SMILESCNc1c(C)cccc1F.Cl
InChIInChI=1S/C8H10FN.ClH/c1-6-4-3-5-7(9)8(6)10-2;/h3-5,10H,1-2H3;1H
InChIKeyFQLWWRBKAIAYPW-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.63
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-fluoro-1-N,2-N-dimethylbenzene-1,2-diamine
CID 69472911
2-bromo-6-fluoro-N-methylaniline
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2-fluoro-6-methoxy-N-methylaniline;hydrochloride
CID 57362323
1-(2,6-difluorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991420
2-ethyl-6-fluoro-N-methylaniline
CID 22769633
2-butyl-6-fluoro-N-methylaniline
CID 22769598
2-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909344
1,2-difluoro-3-methylbenzene;vanadium
CID 170603843
3-N-(2-fluoro-6-methylphenyl)-2,5-dimethylbenzene-1,3-diamine
CID 166965194
5-fluoro-3-N-(2-fluoro-6-methylphenyl)-2-methylbenzene-1,3-diamine
CID 154647860
2-fluoro-N,3-dimethylaniline
CID 50998713
2-chloro-6-fluoro-N,3-dimethylaniline
CID 174640789

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,6-dimethylaniline;hydrochloride?
The IUPAC name of 2-fluoro-N,6-dimethylaniline;hydrochloride (CID 167737520) is 2-fluoro-N,6-dimethylaniline;hydrochloride.
What is the SMILES notation for 2-fluoro-N,6-dimethylaniline;hydrochloride?
The canonical SMILES for 2-fluoro-N,6-dimethylaniline;hydrochloride is CNc1c(C)cccc1F.Cl.
What is the InChIKey of 2-fluoro-N,6-dimethylaniline;hydrochloride?
The InChIKey is FQLWWRBKAIAYPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN.ClH/c1-6-4-3-5-7(9)8(6)10-2;/h3-5,10H,1-2H3;1H.
What are the key properties of 2-fluoro-N,6-dimethylaniline;hydrochloride?
2-fluoro-N,6-dimethylaniline;hydrochloride has a molecular weight of 175.63 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,6-dimethylaniline;hydrochloride is sourced from PubChem (CID 167737520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).