2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine

C14H14ClFN2 — CID 112653700

IUPAC2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCc1cccc(C(N)Cc2cccc(F)c2Cl)n1
InChIInChI=1S/C14H14ClFN2/c1-9-4-2-7-13(18-9)12(17)8-10-5-3-6-11(16)14(10)15/h2-7,12H,8,17H2,1H3
InChIKeyKTZUJZUPQSNZHM-UHFFFAOYSA-N
MW264.73 g/mol
LogP3.43
Rot. Bonds3

About 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine

2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine (PubChem CID 112653700) has the molecular formula C14H14ClFN2 and a molecular weight of 264.73 g/mol. Its IUPAC name is 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine
PubChem CID112653700
Molecular FormulaC14H14ClFN2
Molecular Weight264.73 g/mol
Exact Mass264.08
IUPAC Name2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCc1cccc(C(N)Cc2cccc(F)c2Cl)n1
InChIInChI=1S/C14H14ClFN2/c1-9-4-2-7-13(18-9)12(17)8-10-5-3-6-11(16)14(10)15/h2-7,12H,8,17H2,1H3
InChIKeyKTZUJZUPQSNZHM-UHFFFAOYSA-N
XLogP3.43
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.73
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine
CID 103048658
2-(2-chloro-3-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethanamine
CID 105178948
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 105032385
2-(2-chloro-3-fluorophenyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 112653778
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethanamine
CID 115983920
2-(2-chloro-3-fluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-methylethanamine
CID 105178864
1-(2-chloro-3-fluorophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 112653689
2-(2-bromo-3-fluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)ethanamine
CID 105172090
2-(2-chloro-3-fluorophenyl)-1-(2,5-dimethylphenyl)ethanamine
CID 105032399
2-(2-chloro-3-fluorophenyl)-1-(2,5-dimethylfuran-3-yl)ethanamine
CID 105032520
2-(2-chloro-3-fluorophenyl)-1-(3-fluorophenyl)ethanamine
CID 112653545
1-(4-bromo-3-methylphenyl)-2-(2-chloro-3-fluorophenyl)ethanamine
CID 105032643

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine (CID 112653700) is 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine is Cc1cccc(C(N)Cc2cccc(F)c2Cl)n1.
What is the InChIKey of 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine?
The InChIKey is KTZUJZUPQSNZHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2/c1-9-4-2-7-13(18-9)12(17)8-10-5-3-6-11(16)14(10)15/h2-7,12H,8,17H2,1H3.
What are the key properties of 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine?
2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine has a molecular weight of 264.73 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 112653700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).