1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine

C18H15F2N — CID 43484617

IUPAC1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCNC(c1ccc(F)c(F)c1)c1cccc2ccccc12
InChIInChI=1S/C18H15F2N/c1-21-18(13-9-10-16(19)17(20)11-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,21H,1H3
InChIKeyGSCLZTMGJDYSHR-UHFFFAOYSA-N
MW283.32 g/mol
LogP4.43
Rot. Bonds3

About 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine

1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine (PubChem CID 43484617) has the molecular formula C18H15F2N and a molecular weight of 283.32 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine
PubChem CID43484617
Molecular FormulaC18H15F2N
Molecular Weight283.32 g/mol
Exact Mass283.12
IUPAC Name1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCNC(c1ccc(F)c(F)c1)c1cccc2ccccc12
InChIInChI=1S/C18H15F2N/c1-21-18(13-9-10-16(19)17(20)11-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,21H,1H3
InChIKeyGSCLZTMGJDYSHR-UHFFFAOYSA-N
XLogP4.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,4-difluorophenyl)-1-(2,3-dimethoxyphenyl)-N-methylmethanamine
CID 105145620
4-[methylamino(naphthalen-1-yl)methyl]aniline
CID 116952076
1-(2,5-difluorophenyl)-1-(3,4-difluorophenyl)-N-methylmethanamine
CID 43482905
1-(3,4-difluorophenyl)-1-(3-iodophenyl)-N-methylmethanamine
CID 43484544
2-[[(1R)-1-(3,4-difluorophenyl)ethyl]amino]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
CID 8638957
N-[1-(3,4-difluorophenyl)ethyl]naphthalen-1-amine
CID 43108042
1-(2-fluoro-3-methylphenyl)-1-(4-fluoro-3-methylphenyl)-N-methylmethanamine
CID 81477481
1-(3-bromo-4-fluorophenyl)-1-(2-bromophenyl)-N-methylmethanamine
CID 79746439
4-chloro-N-methyl-2-[(R)-methylamino(naphthalen-1-yl)methyl]aniline
CID 46187257
1-(5-iodothiophen-3-yl)-N-methyl-1-naphthalen-1-ylmethanamine
CID 79692934
N-methyl-1-(2-methylphenyl)-1-naphthalen-1-ylmethanamine
CID 62717419
[(1S)-1-(3,4-difluorophenyl)ethyl]-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl]azanium
CID 8638935

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The IUPAC name of 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine (CID 43484617) is 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The canonical SMILES for 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine is CNC(c1ccc(F)c(F)c1)c1cccc2ccccc12.
What is the InChIKey of 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The InChIKey is GSCLZTMGJDYSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2N/c1-21-18(13-9-10-16(19)17(20)11-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,21H,1H3.
What are the key properties of 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine?
1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine has a molecular weight of 283.32 g/mol, XLogP of 4.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-difluorophenyl)-N-methyl-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 43484617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).