1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine

C14H12ClF2N — CID 55110975

IUPAC1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1cc(F)cc(F)c1)c1ccccc1Cl
InChIInChI=1S/C14H12ClF2N/c1-18-14(12-4-2-3-5-13(12)15)9-6-10(16)8-11(17)7-9/h2-8,14,18H,1H3
InChIKeyFWHOVZRHGIKPPS-UHFFFAOYSA-N
MW267.71 g/mol
LogP3.93
Rot. Bonds3

About 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine

1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine (PubChem CID 55110975) has the molecular formula C14H12ClF2N and a molecular weight of 267.71 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
PubChem CID55110975
Molecular FormulaC14H12ClF2N
Molecular Weight267.71 g/mol
Exact Mass267.06
IUPAC Name1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1cc(F)cc(F)c1)c1ccccc1Cl
InChIInChI=1S/C14H12ClF2N/c1-18-14(12-4-2-3-5-13(12)15)9-6-10(16)8-11(17)7-9/h2-8,14,18H,1H3
InChIKeyFWHOVZRHGIKPPS-UHFFFAOYSA-N
XLogP3.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.71
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chlorophenyl)-1-(3-fluorophenyl)-N-methylmethanamine
CID 55125063
(1S)-1-(2-chloro-4-fluorophenyl)-N-methyl-1-phenylmethanamine
CID 51694296
1-(2-chloro-4-methoxyphenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 43561906
1-(2-chlorophenyl)-1-(3,4-dimethylphenyl)-N-methylmethanamine
CID 43480147
1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 62716429
1-(3-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)-N-methylmethanamine
CID 63502754
1-(2,5-dichlorothiophen-3-yl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 43486794
1-(2-chlorophenyl)-1-(5-iodothiophen-3-yl)-N-methylmethanamine
CID 115801090
N-[(2-chlorophenyl)-(3-fluorophenyl)methyl]ethanamine
CID 61030250
1-(3-bromo-5-fluorophenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 66423844
1-(2,4-difluorophenyl)-N-methyl-1-phenylmethanamine
CID 43481546
1-(2-chloro-5-fluorophenyl)-1-(2,6-dichlorophenyl)-N-methylmethanamine
CID 105397291

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine (CID 55110975) is 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine is CNC(c1cc(F)cc(F)c1)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine?
The InChIKey is FWHOVZRHGIKPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2N/c1-18-14(12-4-2-3-5-13(12)15)9-6-10(16)8-11(17)7-9/h2-8,14,18H,1H3.
What are the key properties of 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine?
1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine has a molecular weight of 267.71 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 55110975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).