2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine

C14H14ClFN2 — CID 66273987

IUPAC2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(N)Cc1ccc(F)cc1Cl
InChIInChI=1S/C14H14ClFN2/c1-9-4-5-18-8-12(9)14(17)6-10-2-3-11(16)7-13(10)15/h2-5,7-8,14H,6,17H2,1H3
InChIKeyFSZBFYZGDJRZQQ-UHFFFAOYSA-N
MW264.73 g/mol
LogP3.43
Rot. Bonds3

About 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine

2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine (PubChem CID 66273987) has the molecular formula C14H14ClFN2 and a molecular weight of 264.73 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine
PubChem CID66273987
Molecular FormulaC14H14ClFN2
Molecular Weight264.73 g/mol
Exact Mass264.08
IUPAC Name2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(N)Cc1ccc(F)cc1Cl
InChIInChI=1S/C14H14ClFN2/c1-9-4-5-18-8-12(9)14(17)6-10-2-3-11(16)7-13(10)15/h2-5,7-8,14H,6,17H2,1H3
InChIKeyFSZBFYZGDJRZQQ-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-(2-chloro-4-fluorophenyl)-1-(2-methylphenyl)ethanamine
CID 55095442
2-(3-chloro-2-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine
CID 82806137
2-(2-chloro-4-fluorophenyl)-1-isoquinolin-5-ylethanamine
CID 63035799
1-(2-chloro-4-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethanamine
CID 106865980
2-(2-chloro-5-fluorophenyl)-1-(3-chloro-4-pyridinyl)ethanamine
CID 102622472
2-(2-chloro-4-fluorophenyl)-1-(2-fluoro-4-methylphenyl)ethanamine
CID 115840484
2-(3-chloro-4-pyridinyl)-1-(2,5-dimethylphenyl)ethanamine
CID 112655409
2-(3-chloro-4-pyridinyl)-1-(2-fluoro-5-methylphenyl)ethanamine
CID 112655458
2-(4-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 114855471
1-(2-chloro-4-fluorophenyl)propan-2-amine
CID 62600100
1-(2,4-dichlorophenyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 105050988
1-(2-chloro-4-fluorophenyl)-2-(2,4-difluorophenyl)ethanamine
CID 55152610

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine (CID 66273987) is 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine is Cc1ccncc1C(N)Cc1ccc(F)cc1Cl.
What is the InChIKey of 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine?
The InChIKey is FSZBFYZGDJRZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2/c1-9-4-5-18-8-12(9)14(17)6-10-2-3-11(16)7-13(10)15/h2-5,7-8,14H,6,17H2,1H3.
What are the key properties of 2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine?
2-(2-chloro-4-fluorophenyl)-1-(4-methyl-3-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-4-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 66273987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).