1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine

C18H15ClFN — CID 79591908

IUPAC1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine
SMILESNC(Cc1ccccc1F)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C18H15ClFN/c19-16-10-9-15(13-6-2-3-7-14(13)16)18(21)11-12-5-1-4-8-17(12)20/h1-10,18H,11,21H2
InChIKeyMSALAFDURVMGNA-UHFFFAOYSA-N
MW299.78 g/mol
LogP4.87
Rot. Bonds3

About 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine

1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine (PubChem CID 79591908) has the molecular formula C18H15ClFN and a molecular weight of 299.78 g/mol. Its IUPAC name is 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine
PubChem CID79591908
Molecular FormulaC18H15ClFN
Molecular Weight299.78 g/mol
Exact Mass299.09
IUPAC Name1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine
SMILESNC(Cc1ccccc1F)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C18H15ClFN/c19-16-10-9-15(13-6-2-3-7-14(13)16)18(21)11-12-5-1-4-8-17(12)20/h1-10,18H,11,21H2
InChIKeyMSALAFDURVMGNA-UHFFFAOYSA-N
XLogP4.87
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.78
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-chloronaphthalen-1-yl)-2-(4-chlorophenyl)ethanamine
CID 79592123
1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 64713277
1-(2-chlorofuran-3-yl)-2-(2-fluorophenyl)ethanamine
CID 106687760
2-(4-bromophenyl)-1-(4-chloronaphthalen-1-yl)ethanamine
CID 79592129
2-(2,3-difluorophenyl)-1-naphthalen-1-ylethanamine
CID 62715879
1-(4-bromo-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 61078893
1-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)ethanamine
CID 105394821
2-(2,4-dichlorophenyl)-1-(2-fluorophenyl)ethanamine
CID 62502807
1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866438
2-(3-chloro-2-fluorophenyl)-1-(2,3,4-trifluorophenyl)ethanamine
CID 82806473
(4-chloro-3-fluorophenyl)-(4-chloronaphthalen-1-yl)methanamine
CID 107998798
1-(4-chloro-2,5-difluorophenyl)-2-(2-chlorophenyl)ethanamine
CID 82773222

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine?
The IUPAC name of 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine (CID 79591908) is 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine?
The canonical SMILES for 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine is NC(Cc1ccccc1F)c1ccc(Cl)c2ccccc12.
What is the InChIKey of 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine?
The InChIKey is MSALAFDURVMGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClFN/c19-16-10-9-15(13-6-2-3-7-14(13)16)18(21)11-12-5-1-4-8-17(12)20/h1-10,18H,11,21H2.
What are the key properties of 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine?
1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine has a molecular weight of 299.78 g/mol, XLogP of 4.87, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 79591908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).