(5-methylsulfanylthiophen-3-yl)methanamine

C6H9NS2 — CID 82415640

IUPAC(5-methylsulfanylthiophen-3-yl)methanamine
SMILESCSc1cc(CN)cs1
InChIInChI=1S/C6H9NS2/c1-8-6-2-5(3-7)4-9-6/h2,4H,3,7H2,1H3
InChIKeyJIYOWOMXADSSGL-UHFFFAOYSA-N
MW159.28 g/mol
LogP1.93
Rot. Bonds2

About (5-methylsulfanylthiophen-3-yl)methanamine

(5-methylsulfanylthiophen-3-yl)methanamine (PubChem CID 82415640) has the molecular formula C6H9NS2 and a molecular weight of 159.28 g/mol. Its IUPAC name is (5-methylsulfanylthiophen-3-yl)methanamine.

Molecular Properties

Compound Name(5-methylsulfanylthiophen-3-yl)methanamine
PubChem CID82415640
Molecular FormulaC6H9NS2
Molecular Weight159.28 g/mol
Exact Mass159.02
IUPAC Name(5-methylsulfanylthiophen-3-yl)methanamine
SMILESCSc1cc(CN)cs1
InChIInChI=1S/C6H9NS2/c1-8-6-2-5(3-7)4-9-6/h2,4H,3,7H2,1H3
InChIKeyJIYOWOMXADSSGL-UHFFFAOYSA-N
XLogP1.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)thiophen-2-amine
CID 45078819
4-(aminomethyl)thiophen-2-amine;hydrochloride
CID 141029895
(5-bromothiophen-3-yl)methanamine
CID 23533436
1-[4-(aminomethyl)thiophen-2-yl]ethanol
CID 82415882
[5-(4,5-diethyl-1H-imidazol-2-yl)thiophen-3-yl]methanamine
CID 103386689
4-(aminomethyl)-N-(2,3,5,6-tetrafluorophenyl)thiophene-2-sulfonamide
CID 106087571
(3,5-difluoro-4-methylsulfanylphenyl)methanamine
CID 63814041
4-(aminomethyl)-N-(1-methylsulfanylpropan-2-yl)thiophene-2-sulfonamide
CID 106079826
(5-nitrothiophen-3-yl)methanamine
CID 60749253
4-(aminomethyl)-N-(2-methyl-3-methylsulfanylpropyl)thiophene-2-sulfonamide
CID 106064908
4-(aminomethyl)-N-(4-methylsulfanylbutan-2-yl)thiophene-2-sulfonamide
CID 114142109
[5-(4-ethyl-5-methyl-1H-imidazol-2-yl)thiophen-3-yl]methanamine
CID 103386757

Frequently Asked Questions

What is the IUPAC name of (5-methylsulfanylthiophen-3-yl)methanamine?
The IUPAC name of (5-methylsulfanylthiophen-3-yl)methanamine (CID 82415640) is (5-methylsulfanylthiophen-3-yl)methanamine.
What is the SMILES notation for (5-methylsulfanylthiophen-3-yl)methanamine?
The canonical SMILES for (5-methylsulfanylthiophen-3-yl)methanamine is CSc1cc(CN)cs1.
What is the InChIKey of (5-methylsulfanylthiophen-3-yl)methanamine?
The InChIKey is JIYOWOMXADSSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NS2/c1-8-6-2-5(3-7)4-9-6/h2,4H,3,7H2,1H3.
What are the key properties of (5-methylsulfanylthiophen-3-yl)methanamine?
(5-methylsulfanylthiophen-3-yl)methanamine has a molecular weight of 159.28 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylsulfanylthiophen-3-yl)methanamine is sourced from PubChem (CID 82415640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).