1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine

C14H16FNOS — CID 53273807

IUPAC1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
SMILESCOCc1ccc(CNCc2ccccc2F)s1
InChIInChI=1S/C14H16FNOS/c1-17-10-13-7-6-12(18-13)9-16-8-11-4-2-3-5-14(11)15/h2-7,16H,8-10H2,1H3
InChIKeyADMXVYBYPYGRQS-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.32
Rot. Bonds6

About 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine

1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine (PubChem CID 53273807) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
PubChem CID53273807
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
SMILESCOCc1ccc(CNCc2ccccc2F)s1
InChIInChI=1S/C14H16FNOS/c1-17-10-13-7-6-12(18-13)9-16-8-11-4-2-3-5-14(11)15/h2-7,16H,8-10H2,1H3
InChIKeyADMXVYBYPYGRQS-UHFFFAOYSA-N
XLogP3.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine (CID 53273807) is 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine is COCc1ccc(CNCc2ccccc2F)s1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The InChIKey is ADMXVYBYPYGRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-17-10-13-7-6-12(18-13)9-16-8-11-4-2-3-5-14(11)15/h2-7,16H,8-10H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine has a molecular weight of 265.35 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine is sourced from PubChem (CID 53273807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).