2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine

C18H20FN — CID 105373089

IUPAC2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
SMILESCc1ccc(F)cc1CC1(N)CCc2ccccc2C1
InChIInChI=1S/C18H20FN/c1-13-6-7-17(19)10-16(13)12-18(20)9-8-14-4-2-3-5-15(14)11-18/h2-7,10H,8-9,11-12,20H2,1H3
InChIKeyDHFMSJOBAKWKDR-UHFFFAOYSA-N
MW269.36 g/mol
LogP3.56
Rot. Bonds2

About 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine

2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 105373089) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID105373089
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC Name2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
SMILESCc1ccc(F)cc1CC1(N)CCc2ccccc2C1
InChIInChI=1S/C18H20FN/c1-13-6-7-17(19)10-16(13)12-18(20)9-8-14-4-2-3-5-15(14)11-18/h2-7,10H,8-9,11-12,20H2,1H3
InChIKeyDHFMSJOBAKWKDR-UHFFFAOYSA-N
XLogP3.56
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(5-fluoro-2-methylphenyl)methyl]-1,3-dihydroinden-2-amine
CID 105373067
2-[(2-bromo-5-fluorophenyl)methyl]-1,3-dihydroinden-2-amine
CID 62621612
2-[(2,4-difluorophenyl)methyl]-1,3-dihydroinden-2-amine
CID 62197516
2-[(2-chloro-4-fluorophenyl)methyl]-1,3-dihydroinden-2-amine
CID 62621053
[2-[(4-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-yl]methanamine
CID 114349753
1-[(5-fluoro-2-methylphenyl)methyl]-4-propylcyclohexan-1-amine
CID 105373056
2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
CID 54919338
1-[(5-fluoro-2-methylphenyl)methyl]-4-propylcycloheptan-1-amine
CID 105373119
5-fluoro-1-[(5-fluoro-2-methylphenyl)methyl]-2,3-dihydroinden-1-ol
CID 105373031
[2-[(4-fluoro-2-methylphenyl)methyl]-1,3-dihydroinden-2-yl]methanamine
CID 114349751
[1-[(5-fluoro-2-methylphenyl)methyl]-4,4-dimethylcyclohexyl]methanamine
CID 105375873
2-(2,6-difluoro-3-methylphenyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 82819713

Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine (CID 105373089) is 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine is Cc1ccc(F)cc1CC1(N)CCc2ccccc2C1.
What is the InChIKey of 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is DHFMSJOBAKWKDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c1-13-6-7-17(19)10-16(13)12-18(20)9-8-14-4-2-3-5-15(14)11-18/h2-7,10H,8-9,11-12,20H2,1H3.
What are the key properties of 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 269.36 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 105373089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).