(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride

C12H13ClFNS — CID 171223396

IUPAC(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
SMILESCc1c(F)cccc1[C@@H](N)c1cccs1.Cl
InChIInChI=1S/C12H12FNS.ClH/c1-8-9(4-2-5-10(8)13)12(14)11-6-3-7-15-11;/h2-7,12H,14H2,1H3;1H/t12-;/m1./s1
InChIKeyLDZWOFMQUZNAMW-UTONKHPSSA-N
MW257.76 g/mol
LogP3.67
Rot. Bonds2

About (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride

(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride (PubChem CID 171223396) has the molecular formula C12H13ClFNS and a molecular weight of 257.76 g/mol. Its IUPAC name is (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride.

Molecular Properties

Compound Name(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
PubChem CID171223396
Molecular FormulaC12H13ClFNS
Molecular Weight257.76 g/mol
Exact Mass257.04
IUPAC Name(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
SMILESCc1c(F)cccc1[C@@H](N)c1cccs1.Cl
InChIInChI=1S/C12H12FNS.ClH/c1-8-9(4-2-5-10(8)13)12(14)11-6-3-7-15-11;/h2-7,12H,14H2,1H3;1H/t12-;/m1./s1
InChIKeyLDZWOFMQUZNAMW-UTONKHPSSA-N
XLogP3.67
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.76
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride 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

(R)-(2,3-difluorophenyl)-thiophen-2-ylmethanamine
CID 94532686
(2-fluorophenyl)-thiophen-2-ylmethanamine
CID 43186746
(S)-(2-chloro-3-fluorophenyl)-thiophen-2-ylmethanamine
CID 171203052
(R)-(2,3-difluoro-4-methylphenyl)-thiophen-2-ylmethanamine
CID 131300822
(S)-thiophen-2-yl-(2,3,4-trifluorophenyl)methanamine;hydrochloride
CID 171205796
(S)-(4-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171201828
2-[(R)-amino(thiophen-2-yl)methyl]-6-fluoro-4-methylphenol;hydrochloride
CID 171253754
2-[(S)-amino(thiophen-2-yl)methyl]-6-fluoro-4-methylphenol;hydrochloride
CID 171257098
(S)-(3-chloro-2-fluorophenyl)-thiophen-2-ylmethanamine
CID 131296076
(R)-(2,4-difluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171218565
(R)-(4-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine
CID 131473320
(R)-(2-bromo-6-fluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171223227

Frequently Asked Questions

What is the IUPAC name of (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride?
The IUPAC name of (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride (CID 171223396) is (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride.
What is the SMILES notation for (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride?
The canonical SMILES for (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride is Cc1c(F)cccc1[C@@H](N)c1cccs1.Cl.
What is the InChIKey of (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride?
The InChIKey is LDZWOFMQUZNAMW-UTONKHPSSA-N. The full InChI is InChI=1S/C12H12FNS.ClH/c1-8-9(4-2-5-10(8)13)12(14)11-6-3-7-15-11;/h2-7,12H,14H2,1H3;1H/t12-;/m1./s1.
What are the key properties of (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride?
(R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride has a molecular weight of 257.76 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-fluoro-2-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride is sourced from PubChem (CID 171223396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).