N-(2,3,4-trifluorophenyl)pyridin-3-amine

C11H7F3N2 — CID 82537499

IUPACN-(2,3,4-trifluorophenyl)pyridin-3-amine
SMILESFc1ccc(Nc2cccnc2)c(F)c1F
InChIInChI=1S/C11H7F3N2/c12-8-3-4-9(11(14)10(8)13)16-7-2-1-5-15-6-7/h1-6,16H
InChIKeyIKMUSBWWLOTNJZ-UHFFFAOYSA-N
MW224.19 g/mol
LogP3.24
Rot. Bonds2

About N-(2,3,4-trifluorophenyl)pyridin-3-amine

N-(2,3,4-trifluorophenyl)pyridin-3-amine (PubChem CID 82537499) has the molecular formula C11H7F3N2 and a molecular weight of 224.19 g/mol. Its IUPAC name is N-(2,3,4-trifluorophenyl)pyridin-3-amine.

Molecular Properties

Compound NameN-(2,3,4-trifluorophenyl)pyridin-3-amine
PubChem CID82537499
Molecular FormulaC11H7F3N2
Molecular Weight224.19 g/mol
Exact Mass224.06
IUPAC NameN-(2,3,4-trifluorophenyl)pyridin-3-amine
SMILESFc1ccc(Nc2cccnc2)c(F)c1F
InChIInChI=1S/C11H7F3N2/c12-8-3-4-9(11(14)10(8)13)16-7-2-1-5-15-6-7/h1-6,16H
InChIKeyIKMUSBWWLOTNJZ-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.19
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-4-(pyridin-3-ylamino)benzonitrile
CID 43657005
N-(4-chlorophenyl)-2,3,4-trifluoroaniline
CID 82536911
N-(5-chloro-2-methylphenyl)pyridin-3-amine
CID 82536338
4-chloro-2-N-pyridin-3-ylbenzene-1,2-diamine
CID 115127653
4-chloro-2-(pyridin-3-ylamino)phenol
CID 102179670
4-fluoro-2-(pyridin-3-ylamino)benzoic acid
CID 139804655
N-pyridin-3-ylpyrimidin-2-amine
CID 11593513
ethane;N-(2-methylphenyl)pyridin-3-amine
CID 143449341
N-fluoropyridin-3-amine
CID 141274626
2-fluoro-5-(pyridin-3-ylamino)benzoic acid
CID 82537495
N-(5-fluoro-2-methoxyphenyl)pyridin-3-amine
CID 82537505
1-(pyridin-3-ylmethyl)-3-(2,3,4-trifluorophenyl)urea
CID 47193920

Frequently Asked Questions

What is the IUPAC name of N-(2,3,4-trifluorophenyl)pyridin-3-amine?
The IUPAC name of N-(2,3,4-trifluorophenyl)pyridin-3-amine (CID 82537499) is N-(2,3,4-trifluorophenyl)pyridin-3-amine.
What is the SMILES notation for N-(2,3,4-trifluorophenyl)pyridin-3-amine?
The canonical SMILES for N-(2,3,4-trifluorophenyl)pyridin-3-amine is Fc1ccc(Nc2cccnc2)c(F)c1F.
What is the InChIKey of N-(2,3,4-trifluorophenyl)pyridin-3-amine?
The InChIKey is IKMUSBWWLOTNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N2/c12-8-3-4-9(11(14)10(8)13)16-7-2-1-5-15-6-7/h1-6,16H.
What are the key properties of N-(2,3,4-trifluorophenyl)pyridin-3-amine?
N-(2,3,4-trifluorophenyl)pyridin-3-amine has a molecular weight of 224.19 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,4-trifluorophenyl)pyridin-3-amine is sourced from PubChem (CID 82537499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).