3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine

C10H10Cl2F3N — CID 82534938

IUPAC3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine
SMILESCNC(Cc1cccc(Cl)c1Cl)C(F)(F)F
InChIInChI=1S/C10H10Cl2F3N/c1-16-8(10(13,14)15)5-6-3-2-4-7(11)9(6)12/h2-4,8,16H,5H2,1H3
InChIKeyGFCIZXBZLPPENY-UHFFFAOYSA-N
MW272.10 g/mol
LogP3.69
Rot. Bonds3

About 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine

3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine (PubChem CID 82534938) has the molecular formula C10H10Cl2F3N and a molecular weight of 272.10 g/mol. Its IUPAC name is 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine.

Molecular Properties

Compound Name3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine
PubChem CID82534938
Molecular FormulaC10H10Cl2F3N
Molecular Weight272.10 g/mol
Exact Mass271.01
IUPAC Name3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine
SMILESCNC(Cc1cccc(Cl)c1Cl)C(F)(F)F
InChIInChI=1S/C10H10Cl2F3N/c1-16-8(10(13,14)15)5-6-3-2-4-7(11)9(6)12/h2-4,8,16H,5H2,1H3
InChIKeyGFCIZXBZLPPENY-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.10
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-chlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine
CID 66467241
3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-propylpropan-2-amine
CID 107312354
1-(2,3-dichlorophenyl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 107309192
3-[(2,3-dichlorophenyl)methyl]-4,4,4-trifluorobutan-1-amine
CID 82534769
3-(2,3-dichlorophenyl)-2-methyl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 107309848
2-(2,3-dichlorophenyl)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 107312240
1-(2,3-dichlorophenyl)-3-(methylamino)propan-2-ol
CID 82290486
1-(3-chloro-2-fluorophenyl)-3-methoxy-N,3-dimethylbutan-2-amine
CID 102857757
1-(2,3-dichlorophenyl)propane-2-thiol
CID 169111936
1-(2,3-dichlorophenyl)-4,4,4-trifluoro-N-propylbutan-2-amine
CID 107308478
2-(2,3-dichlorophenyl)-1-(furan-2-yl)-N-methylethanamine
CID 107308555
1-(2,3-dichlorophenyl)-3-N,3-N,3-trimethyl-2-N-propylbutane-2,3-diamine
CID 107308776

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine?
The IUPAC name of 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine (CID 82534938) is 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine.
What is the SMILES notation for 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine?
The canonical SMILES for 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine is CNC(Cc1cccc(Cl)c1Cl)C(F)(F)F.
What is the InChIKey of 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine?
The InChIKey is GFCIZXBZLPPENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2F3N/c1-16-8(10(13,14)15)5-6-3-2-4-7(11)9(6)12/h2-4,8,16H,5H2,1H3.
What are the key properties of 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine?
3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine has a molecular weight of 272.10 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichlorophenyl)-1,1,1-trifluoro-N-methylpropan-2-amine is sourced from PubChem (CID 82534938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).