(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine

C18H16FN — CID 115850991

IUPAC(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine
SMILESCc1cccc(C(N)c2ccc3ccccc3c2)c1F
InChIInChI=1S/C18H16FN/c1-12-5-4-8-16(17(12)19)18(20)15-10-9-13-6-2-3-7-14(13)11-15/h2-11,18H,20H2,1H3
InChIKeyQBYVTYMCMLAKRU-UHFFFAOYSA-N
MW265.33 g/mol
LogP4.34
Rot. Bonds2

About (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine

(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine (PubChem CID 115850991) has the molecular formula C18H16FN and a molecular weight of 265.33 g/mol. Its IUPAC name is (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine.

Molecular Properties

Compound Name(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine
PubChem CID115850991
Molecular FormulaC18H16FN
Molecular Weight265.33 g/mol
Exact Mass265.13
IUPAC Name(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine
SMILESCc1cccc(C(N)c2ccc3ccccc3c2)c1F
InChIInChI=1S/C18H16FN/c1-12-5-4-8-16(17(12)19)18(20)15-10-9-13-6-2-3-7-14(13)11-15/h2-11,18H,20H2,1H3
InChIKeyQBYVTYMCMLAKRU-UHFFFAOYSA-N
XLogP4.34
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-fluoro-3-methoxyphenyl)-naphthalen-2-ylmethanamine
CID 82793131
(4-tert-butylphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 81477384
(2-methoxyphenyl)-naphthalen-2-ylmethanamine
CID 62715547
(2-fluoro-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanamine
CID 81480693
(5-bromo-2-methylphenyl)-naphthalen-2-ylmethanamine
CID 115851118
(4-fluorophenyl)-naphthalen-2-ylmethanamine
CID 43184816
1-benzothiophen-7-yl(naphthalen-2-yl)methanamine
CID 81129802
(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine
CID 43149180
(2-fluoro-3-methylphenyl)-(furan-3-yl)methanamine
CID 115855456
(3,4-dimethylphenyl)-(2-fluoro-3-methoxyphenyl)methanamine
CID 105024853
(2,6-difluorophenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 115859741
5-[amino-(2-fluoro-3-methylphenyl)methyl]-1,3-dihydroindol-2-one
CID 81477151

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine?
The IUPAC name of (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine (CID 115850991) is (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine.
What is the SMILES notation for (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine?
The canonical SMILES for (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine is Cc1cccc(C(N)c2ccc3ccccc3c2)c1F.
What is the InChIKey of (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine?
The InChIKey is QBYVTYMCMLAKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN/c1-12-5-4-8-16(17(12)19)18(20)15-10-9-13-6-2-3-7-14(13)11-15/h2-11,18H,20H2,1H3.
What are the key properties of (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine?
(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine has a molecular weight of 265.33 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine is sourced from PubChem (CID 115850991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).