1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine

C12H12FNS — CID 43393729

IUPAC1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cccs1
InChIInChI=1S/C12H12FNS/c1-14-12(11-3-2-8-15-11)9-4-6-10(13)7-5-9/h2-8,12,14H,1H3
InChIKeyVDCKTGSZIBPVSB-UHFFFAOYSA-N
MW221.30 g/mol
LogP3.20
Rot. Bonds3

About 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine

1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine (PubChem CID 43393729) has the molecular formula C12H12FNS and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine
PubChem CID43393729
Molecular FormulaC12H12FNS
Molecular Weight221.30 g/mol
Exact Mass221.07
IUPAC Name1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cccs1
InChIInChI=1S/C12H12FNS/c1-14-12(11-3-2-8-15-11)9-4-6-10(13)7-5-9/h2-8,12,14H,1H3
InChIKeyVDCKTGSZIBPVSB-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-thiophen-2-yl-1-[4-(trifluoromethyl)phenyl]methanamine
CID 43483425
1-(3-fluoro-4-methylphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483467
N-[(S)-(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide
CID 41099331
1-(4-butan-2-ylphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43393747
1,1-bis(4-fluorophenyl)-N-methylmethanamine
CID 22660961
1-[3-fluoro-4-(trifluoromethyl)phenyl]-N-methyl-1-thiophen-2-ylmethanamine
CID 107288722
methyl 2-[[(R)-(4-fluorophenyl)-thiophen-2-ylmethyl]amino]acetate
CID 94176340
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-4-(methylamino)butanamide
CID 61258454
ethyl N-[(4-fluorophenyl)-thiophen-2-ylmethyl]carbamate
CID 60664930
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide
CID 46565128
1-chloro-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]methanesulfonamide
CID 63665118
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-methylcyclopropane-1-carboxamide
CID 17404206

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine?
The IUPAC name of 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine (CID 43393729) is 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine?
The canonical SMILES for 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine is CNC(c1ccc(F)cc1)c1cccs1.
What is the InChIKey of 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine?
The InChIKey is VDCKTGSZIBPVSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FNS/c1-14-12(11-3-2-8-15-11)9-4-6-10(13)7-5-9/h2-8,12,14H,1H3.
What are the key properties of 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine?
1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine has a molecular weight of 221.30 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine is sourced from PubChem (CID 43393729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).