2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine

C12H10ClFN2O — CID 174787583

IUPAC2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine
SMILESCOc1cnc(-c2ccc(Cl)cc2)c(F)c1N
InChIInChI=1S/C12H10ClFN2O/c1-17-9-6-16-12(10(14)11(9)15)7-2-4-8(13)5-3-7/h2-6H,1H3,(H2,15,16)
InChIKeyFJLVABLUNNFBEC-UHFFFAOYSA-N
MW252.68 g/mol
LogP3.13
Rot. Bonds2

About 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine

2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine (PubChem CID 174787583) has the molecular formula C12H10ClFN2O and a molecular weight of 252.68 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine
PubChem CID174787583
Molecular FormulaC12H10ClFN2O
Molecular Weight252.68 g/mol
Exact Mass252.05
IUPAC Name2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine
SMILESCOc1cnc(-c2ccc(Cl)cc2)c(F)c1N
InChIInChI=1S/C12H10ClFN2O/c1-17-9-6-16-12(10(14)11(9)15)7-2-4-8(13)5-3-7/h2-6H,1H3,(H2,15,16)
InChIKeyFJLVABLUNNFBEC-UHFFFAOYSA-N
XLogP3.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.68
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-3-fluoro-5-methoxypyridin-4-amine
CID 141356822
2-(4-chlorophenyl)-3-methoxypyridine
CID 90122541
methyl 4-amino-6-(4-chlorophenyl)-5-fluoro-3-methylpyridine-2-carboxylate
CID 59432126
4-(4-chlorophenyl)-6,7-dimethoxyquinazolin-2-amine
CID 22626608
methyl 4-amino-6-(4-chlorophenyl)-5-fluoro-3-(1-fluoroethenyl)pyridine-2-carboxylate
CID 59432141
methyl 4-amino-6-(4-chlorophenyl)-5-fluoro-3-(2-trimethylsilylethenyl)pyridine-2-carboxylate
CID 70498124
2-chloro-3,6-difluoro-4-methoxyaniline
CID 106701641
2-(4-fluoro-3-methoxyphenyl)pyrimidin-5-amine
CID 107922532
5-chloro-6-(3,4-dimethoxyphenyl)pyridin-3-amine
CID 166595375
5-chloro-2-(3-fluoro-4-methoxyphenyl)aniline
CID 81274573
5-(3-fluoro-4-methoxyphenyl)pyrimidin-2-amine
CID 57445392
2-(4-chlorophenyl)-5-methoxy-4-[3-(trifluoromethyl)phenyl]pyrimidine
CID 10428889

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine?
The IUPAC name of 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine (CID 174787583) is 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine.
What is the SMILES notation for 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine?
The canonical SMILES for 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine is COc1cnc(-c2ccc(Cl)cc2)c(F)c1N.
What is the InChIKey of 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine?
The InChIKey is FJLVABLUNNFBEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2O/c1-17-9-6-16-12(10(14)11(9)15)7-2-4-8(13)5-3-7/h2-6H,1H3,(H2,15,16).
What are the key properties of 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine?
2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine has a molecular weight of 252.68 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-fluoro-5-methoxypyridin-4-amine is sourced from PubChem (CID 174787583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).