(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine

C14H13ClFN — CID 82087273

IUPAC(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine
SMILESCc1ccccc1C(N)c1c(F)cccc1Cl
InChIInChI=1S/C14H13ClFN/c1-9-5-2-3-6-10(9)14(17)13-11(15)7-4-8-12(13)16/h2-8,14H,17H2,1H3
InChIKeyZUUOPXCZEMJFMK-UHFFFAOYSA-N
MW249.72 g/mol
LogP3.84
Rot. Bonds2

About (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine

(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine (PubChem CID 82087273) has the molecular formula C14H13ClFN and a molecular weight of 249.72 g/mol. Its IUPAC name is (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine.

Molecular Properties

Compound Name(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine
PubChem CID82087273
Molecular FormulaC14H13ClFN
Molecular Weight249.72 g/mol
Exact Mass249.07
IUPAC Name(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine
SMILESCc1ccccc1C(N)c1c(F)cccc1Cl
InChIInChI=1S/C14H13ClFN/c1-9-5-2-3-6-10(9)14(17)13-11(15)7-4-8-12(13)16/h2-8,14H,17H2,1H3
InChIKeyZUUOPXCZEMJFMK-UHFFFAOYSA-N
XLogP3.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.72
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-6-fluorophenyl)-(2-iodo-3-methylphenyl)methanamine
CID 114275416
(2,6-difluorophenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 115859741
3-amino-2-(2-chloro-6-fluorophenyl)-1-(2-methylphenyl)propan-1-ol
CID 65186435
(2-chloro-6-fluorophenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626075
(2-chloro-4,5-difluorophenyl)-(2-methylphenyl)methanamine
CID 107476078
(2-chloro-6-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanamine
CID 104545797
(2,6-dichlorophenyl)-(2,6-difluoro-3-methylphenyl)methanamine
CID 105027044
1-(2-chloro-6-fluorophenyl)ethanamine
CID 53394777
(2-chloro-4,5-dimethoxyphenyl)-(2-chloro-6-fluorophenyl)methanamine
CID 43330575
3-(2-chloro-6-fluorophenyl)butan-2-amine
CID 126977015
(2-chloro-3-fluorophenyl)-(2-chlorophenyl)methanamine
CID 115801340
(3-chloro-2-fluorophenyl)-(2,3-dimethylphenyl)methanamine
CID 64713808

Frequently Asked Questions

What is the IUPAC name of (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine?
The IUPAC name of (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine (CID 82087273) is (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine.
What is the SMILES notation for (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine?
The canonical SMILES for (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine is Cc1ccccc1C(N)c1c(F)cccc1Cl.
What is the InChIKey of (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine?
The InChIKey is ZUUOPXCZEMJFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClFN/c1-9-5-2-3-6-10(9)14(17)13-11(15)7-4-8-12(13)16/h2-8,14H,17H2,1H3.
What are the key properties of (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine?
(2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine has a molecular weight of 249.72 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-6-fluorophenyl)-(2-methylphenyl)methanamine is sourced from PubChem (CID 82087273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).