1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine

C18H16ClN — CID 62716429

IUPAC1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1ccccc1Cl
InChIInChI=1S/C18H16ClN/c1-20-18(16-8-4-5-9-17(16)19)15-11-10-13-6-2-3-7-14(13)12-15/h2-12,18,20H,1H3
InChIKeyXQMLKGHZHYQQCF-UHFFFAOYSA-N
MW281.79 g/mol
LogP4.80
Rot. Bonds3

About 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine

1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine (PubChem CID 62716429) has the molecular formula C18H16ClN and a molecular weight of 281.79 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
PubChem CID62716429
Molecular FormulaC18H16ClN
Molecular Weight281.79 g/mol
Exact Mass281.10
IUPAC Name1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1ccccc1Cl
InChIInChI=1S/C18H16ClN/c1-20-18(16-8-4-5-9-17(16)19)15-11-10-13-6-2-3-7-14(13)12-15/h2-12,18,20H,1H3
InChIKeyXQMLKGHZHYQQCF-UHFFFAOYSA-N
XLogP4.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,4-dichlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 63502238
1-(2-chloro-4-methylphenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 106857455
1-(3,4-dichlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 43486537
1-(2-chlorophenyl)-N-methyl-1-quinolin-7-ylmethanamine
CID 81231599
1-(2-chlorophenyl)-1-(3,4-dimethylphenyl)-N-methylmethanamine
CID 43480147
1-(2-chlorophenyl)-1-(3-fluorophenyl)-N-methylmethanamine
CID 55125063
1-(2-chlorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 55110975
1-(5-chlorofuran-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 106691917
1-(3-bromo-2-fluorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 106645505
[(6-bromonaphthalen-2-yl)-(2-chlorophenyl)methyl]hydrazine
CID 105287430
1-(2-fluoro-4-methylphenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 115850961
1-(2-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)-N-methylmethanamine
CID 43482503

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine?
The IUPAC name of 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine (CID 62716429) is 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine.
What is the SMILES notation for 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine?
The canonical SMILES for 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine is CNC(c1ccc2ccccc2c1)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine?
The InChIKey is XQMLKGHZHYQQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN/c1-20-18(16-8-4-5-9-17(16)19)15-11-10-13-6-2-3-7-14(13)12-15/h2-12,18,20H,1H3.
What are the key properties of 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine?
1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine has a molecular weight of 281.79 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-methyl-1-naphthalen-2-ylmethanamine is sourced from PubChem (CID 62716429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).