(R)-1H-indol-6-yl(thiophen-3-yl)methanamine

C13H12N2S — CID 171225193

IUPAC(R)-1H-indol-6-yl(thiophen-3-yl)methanamine
SMILESN[C@@H](c1ccsc1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C13H12N2S/c14-13(11-4-6-16-8-11)10-2-1-9-3-5-15-12(9)7-10/h1-8,13,15H,14H2/t13-/m1/s1
InChIKeyPWNJCGQBIWRDMI-CYBMUJFWSA-N
MW228.32 g/mol
LogP3.28
Rot. Bonds2

About (R)-1H-indol-6-yl(thiophen-3-yl)methanamine

(R)-1H-indol-6-yl(thiophen-3-yl)methanamine (PubChem CID 171225193) has the molecular formula C13H12N2S and a molecular weight of 228.32 g/mol. Its IUPAC name is (R)-1H-indol-6-yl(thiophen-3-yl)methanamine.

Molecular Properties

Compound Name(R)-1H-indol-6-yl(thiophen-3-yl)methanamine
PubChem CID171225193
Molecular FormulaC13H12N2S
Molecular Weight228.32 g/mol
Exact Mass228.07
IUPAC Name(R)-1H-indol-6-yl(thiophen-3-yl)methanamine
SMILESN[C@@H](c1ccsc1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C13H12N2S/c14-13(11-4-6-16-8-11)10-2-1-9-3-5-15-12(9)7-10/h1-8,13,15H,14H2/t13-/m1/s1
InChIKeyPWNJCGQBIWRDMI-CYBMUJFWSA-N
XLogP3.28
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-1H-indol-6-yl(thiophen-3-yl)methanamine?
The IUPAC name of (R)-1H-indol-6-yl(thiophen-3-yl)methanamine (CID 171225193) is (R)-1H-indol-6-yl(thiophen-3-yl)methanamine.
What is the SMILES notation for (R)-1H-indol-6-yl(thiophen-3-yl)methanamine?
The canonical SMILES for (R)-1H-indol-6-yl(thiophen-3-yl)methanamine is N[C@@H](c1ccsc1)c1ccc2cc[nH]c2c1.
What is the InChIKey of (R)-1H-indol-6-yl(thiophen-3-yl)methanamine?
The InChIKey is PWNJCGQBIWRDMI-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H12N2S/c14-13(11-4-6-16-8-11)10-2-1-9-3-5-15-12(9)7-10/h1-8,13,15H,14H2/t13-/m1/s1.
What are the key properties of (R)-1H-indol-6-yl(thiophen-3-yl)methanamine?
(R)-1H-indol-6-yl(thiophen-3-yl)methanamine has a molecular weight of 228.32 g/mol, XLogP of 3.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-1H-indol-6-yl(thiophen-3-yl)methanamine is sourced from PubChem (CID 171225193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).