[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine

C18H16FNO — CID 43505452

IUPAC[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
SMILESNCc1c(OCc2cccc(F)c2)ccc2ccccc12
InChIInChI=1S/C18H16FNO/c19-15-6-3-4-13(10-15)12-21-18-9-8-14-5-1-2-7-16(14)17(18)11-20/h1-10H,11-12,20H2
InChIKeyYDPABOIAZTXNTC-UHFFFAOYSA-N
MW281.33 g/mol
LogP4.02
Rot. Bonds4

About [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine

[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine (PubChem CID 43505452) has the molecular formula C18H16FNO and a molecular weight of 281.33 g/mol. Its IUPAC name is [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
PubChem CID43505452
Molecular FormulaC18H16FNO
Molecular Weight281.33 g/mol
Exact Mass281.12
IUPAC Name[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
SMILESNCc1c(OCc2cccc(F)c2)ccc2ccccc12
InChIInChI=1S/C18H16FNO/c19-15-6-3-4-13(10-15)12-21-18-9-8-14-5-1-2-7-16(14)17(18)11-20/h1-10H,11-12,20H2
InChIKeyYDPABOIAZTXNTC-UHFFFAOYSA-N
XLogP4.02
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-phenylmethoxynaphthalen-1-yl)ethanamine
CID 60905443
7-fluoro-1-phenylmethoxynaphthalene
CID 154464455
1-(chloromethyl)-2-[(3-chlorophenyl)methoxy]naphthalene
CID 43505675
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
CID 964391
[2-[(3-bromophenyl)methoxy]naphthalen-1-yl]methanol
CID 43505743
(2-fluoro-6-phenylmethoxyphenyl)methanamine
CID 23071556
[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine
CID 20985427
N-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl]-2-phenylethanamine
CID 4715865
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate
CID 175568006
2-[2-[(3,4-dichlorophenyl)methoxy]naphthalen-1-yl]ethanamine
CID 20985453
1-fluoro-3-[[2-[(3-fluorophenyl)methyl]phenoxy]methyl]benzene
CID 141193012
1,2-bis(phenylmethoxy)naphthalene
CID 67710722

Frequently Asked Questions

What is the IUPAC name of [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine?
The IUPAC name of [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine (CID 43505452) is [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine.
What is the SMILES notation for [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine?
The canonical SMILES for [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine is NCc1c(OCc2cccc(F)c2)ccc2ccccc12.
What is the InChIKey of [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine?
The InChIKey is YDPABOIAZTXNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO/c19-15-6-3-4-13(10-15)12-21-18-9-8-14-5-1-2-7-16(14)17(18)11-20/h1-10H,11-12,20H2.
What are the key properties of [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine?
[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine has a molecular weight of 281.33 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine is sourced from PubChem (CID 43505452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).