(3-fluorophenyl)-thiophen-3-ylmethanamine

C11H10FNS — CID 60819674

IUPAC(3-fluorophenyl)-thiophen-3-ylmethanamine
SMILESNC(c1ccsc1)c1cccc(F)c1
InChIInChI=1S/C11H10FNS/c12-10-3-1-2-8(6-10)11(13)9-4-5-14-7-9/h1-7,11H,13H2
InChIKeyZTSCDXSUVMPASU-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.94
Rot. Bonds2

About (3-fluorophenyl)-thiophen-3-ylmethanamine

(3-fluorophenyl)-thiophen-3-ylmethanamine (PubChem CID 60819674) has the molecular formula C11H10FNS and a molecular weight of 207.27 g/mol. Its IUPAC name is (3-fluorophenyl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(3-fluorophenyl)-thiophen-3-ylmethanamine
PubChem CID60819674
Molecular FormulaC11H10FNS
Molecular Weight207.27 g/mol
Exact Mass207.05
IUPAC Name(3-fluorophenyl)-thiophen-3-ylmethanamine
SMILESNC(c1ccsc1)c1cccc(F)c1
InChIInChI=1S/C11H10FNS/c12-10-3-1-2-8(6-10)11(13)9-4-5-14-7-9/h1-7,11H,13H2
InChIKeyZTSCDXSUVMPASU-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-(3-fluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171199158
(3-methylphenyl)-thiophen-3-ylmethanamine
CID 60819503
3-[(R)-amino(thiophen-3-yl)methyl]phenol;hydrochloride
CID 171218066
3-[(S)-amino(thiophen-3-yl)methyl]phenol;hydrochloride
CID 171198549
(S)-(3-bromophenyl)-thiophen-3-ylmethanamine
CID 171199224
(4-fluorophenyl)-thiophen-3-ylmethanamine
CID 43463924
(R)-(3-bromophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171218747
(R)-(3-chlorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171219113
(R)-(3,4-difluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171229652
(S)-(4-bromo-3-fluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171201796
4-[(S)-amino(thiophen-3-yl)methyl]-2-fluorophenol
CID 171198764
(R)-(4-chloro-3-fluorophenyl)-thiophen-3-ylmethanamine
CID 171229047

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-thiophen-3-ylmethanamine?
The IUPAC name of (3-fluorophenyl)-thiophen-3-ylmethanamine (CID 60819674) is (3-fluorophenyl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (3-fluorophenyl)-thiophen-3-ylmethanamine?
The canonical SMILES for (3-fluorophenyl)-thiophen-3-ylmethanamine is NC(c1ccsc1)c1cccc(F)c1.
What is the InChIKey of (3-fluorophenyl)-thiophen-3-ylmethanamine?
The InChIKey is ZTSCDXSUVMPASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNS/c12-10-3-1-2-8(6-10)11(13)9-4-5-14-7-9/h1-7,11H,13H2.
What are the key properties of (3-fluorophenyl)-thiophen-3-ylmethanamine?
(3-fluorophenyl)-thiophen-3-ylmethanamine has a molecular weight of 207.27 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 60819674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).