1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine

C14H16FNOS — CID 53273761

IUPAC1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
SMILESCOCc1ccc(CNCc2ccc(F)cc2)s1
InChIInChI=1S/C14H16FNOS/c1-17-10-14-7-6-13(18-14)9-16-8-11-2-4-12(15)5-3-11/h2-7,16H,8-10H2,1H3
InChIKeyBDWHDZNXWNFISC-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.32
Rot. Bonds6

About 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine

1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine (PubChem CID 53273761) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
PubChem CID53273761
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine
SMILESCOCc1ccc(CNCc2ccc(F)cc2)s1
InChIInChI=1S/C14H16FNOS/c1-17-10-14-7-6-13(18-14)9-16-8-11-2-4-12(15)5-3-11/h2-7,16H,8-10H2,1H3
InChIKeyBDWHDZNXWNFISC-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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Related Compounds

({1-[2-(4-fluorophenyl)ethyl]-4-piperidinyl}methyl)methyl{[5-(tetrahydro-2H-pyran-2-yl)-2-thienyl]methyl}amine
CID 45244841
1-(4-Fluorobenzyl)-3-(2-methoxy-2-(5-methylthiophen-2-yl)ethyl)urea
CID 71810440
(Z)-2-fluoro-1-N'-[(2-fluorophenyl)methyl]-1-N-methyl-3-(thiophen-2-ylmethoxymethylimino)prop-1-ene-1,1-diamine
CID 70990505
thiophen-3-ylmethyl N-[(2,4,5-trifluorophenyl)methyl]carbamate
CID 141082992
[5-(4-Fluorophenyl)thiophen-2-yl]-(propan-2-ylamino)methanol
CID 156256708
(3R)-3-[(2-fluoro-4,5-dihydro-1-benzothiophen-7-yl)oxy]-N-methyl-3-phenylpropan-1-amine
CID 164172285
2-Ethyl-2'-(4-fluorophenyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 169137689
3-ethyl-2-(4-fluorophenyl)-4-thiophen-2-yl-2H-1,3-oxazole
CID 173220288
1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-N-methyl-N-[[5-[(2S)-oxan-2-yl]thiophen-2-yl]methyl]methanamine
CID 42465850
1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-N-methyl-N-[[5-[(2R)-oxan-2-yl]thiophen-2-yl]methyl]methanamine
CID 42465855
N-[[5-(methoxymethyl)thiophen-2-yl]methyl]-1-[3-(trifluoromethyl)phenyl]methanamine
CID 53273668
N-[[5-(methoxymethyl)thiophen-2-yl]methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 53273669

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The IUPAC name of 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine (CID 53273761) is 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine is COCc1ccc(CNCc2ccc(F)cc2)s1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
The InChIKey is BDWHDZNXWNFISC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-17-10-14-7-6-13(18-14)9-16-8-11-2-4-12(15)5-3-11/h2-7,16H,8-10H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine?
1-(4-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-(4-fluorophenyl)-N-[[5-(methoxymethyl)thiophen-2-yl]methyl]methanamine is sourced from PubChem (CID 53273761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).