6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine

C16H11Cl3FN3 — CID 160664212

IUPAC6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine
SMILESClc1cccc(Cl)n1.Fc1ccc(Nc2cccc(Cl)n2)cc1
InChIInChI=1S/C11H8ClFN2.C5H3Cl2N/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9;6-4-2-1-3-5(7)8-4/h1-7H,(H,14,15);1-3H
InChIKeyRMBNRSKQFVVTEN-UHFFFAOYSA-N
MW370.64 g/mol
LogP6.01
Rot. Bonds2

About 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine

6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine (PubChem CID 160664212) has the molecular formula C16H11Cl3FN3 and a molecular weight of 370.64 g/mol. Its IUPAC name is 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine.

Molecular Properties

Compound Name6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine
PubChem CID160664212
Molecular FormulaC16H11Cl3FN3
Molecular Weight370.64 g/mol
Exact Mass369.00
IUPAC Name6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine
SMILESClc1cccc(Cl)n1.Fc1ccc(Nc2cccc(Cl)n2)cc1
InChIInChI=1S/C11H8ClFN2.C5H3Cl2N/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9;6-4-2-1-3-5(7)8-4/h1-7H,(H,14,15);1-3H
InChIKeyRMBNRSKQFVVTEN-UHFFFAOYSA-N
XLogP6.01
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.64
LogP ≤ 56.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(3-chloro-5-fluorophenyl)pyridin-2-amine
CID 107368827
1-[(6-chloro-2-pyridinyl)amino]-3-(4-fluorophenyl)urea
CID 901022
6-chloro-N-(4-methoxyphenyl)pyridin-2-amine;2,6-dichloropyridine;4-methoxyaniline
CID 161024546
5-[(6-chloro-2-pyridinyl)amino]-2-fluorobenzonitrile
CID 63587476
6-chloro-N-(4-fluoro-2-methylphenyl)pyridin-2-amine
CID 63588779
6-chloro-N-fluoropyridin-2-amine
CID 171556919
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 63585961
6-chloro-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 63588805
6-chloro-3-fluoro-N-(4-fluorophenyl)pyridin-2-amine
CID 90134132
6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridin-2-amine
CID 60727080
N-[3-bromo-4-(trifluoromethoxy)phenyl]-6-chloropyridin-2-amine
CID 107336659
4-[(6-chloro-2-pyridinyl)amino]-2-(trifluoromethyl)benzonitrile
CID 65485739

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine?
The IUPAC name of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine (CID 160664212) is 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine.
What is the SMILES notation for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine?
The canonical SMILES for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine is Clc1cccc(Cl)n1.Fc1ccc(Nc2cccc(Cl)n2)cc1.
What is the InChIKey of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine?
The InChIKey is RMBNRSKQFVVTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2.C5H3Cl2N/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9;6-4-2-1-3-5(7)8-4/h1-7H,(H,14,15);1-3H.
What are the key properties of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine?
6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine has a molecular weight of 370.64 g/mol, XLogP of 6.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine is sourced from PubChem (CID 160664212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).