(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine

C11H13NS2 — CID 104988308

IUPAC(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine
SMILESCCc1ccsc1C(N)c1ccsc1
InChIInChI=1S/C11H13NS2/c1-2-8-4-6-14-11(8)10(12)9-3-5-13-7-9/h3-7,10H,2,12H2,1H3
InChIKeyDNYGEEPHJYDETR-UHFFFAOYSA-N
MW223.37 g/mol
LogP3.42
Rot. Bonds3

About (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine

(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine (PubChem CID 104988308) has the molecular formula C11H13NS2 and a molecular weight of 223.37 g/mol. Its IUPAC name is (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine
PubChem CID104988308
Molecular FormulaC11H13NS2
Molecular Weight223.37 g/mol
Exact Mass223.05
IUPAC Name(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine
SMILESCCc1ccsc1C(N)c1ccsc1
InChIInChI=1S/C11H13NS2/c1-2-8-4-6-14-11(8)10(12)9-3-5-13-7-9/h3-7,10H,2,12H2,1H3
InChIKeyDNYGEEPHJYDETR-UHFFFAOYSA-N
XLogP3.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.37
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-ethylthiophen-2-yl)-(4-methylphenyl)methanamine
CID 79985619
(3-ethylthiophen-2-yl)-(4-phenylphenyl)methanamine
CID 79972493
(S)-(3-chlorothiophen-2-yl)-thiophen-3-ylmethanamine;hydrochloride
CID 171222771
(3-ethylthiophen-2-yl)-[4-(2-methylpropyl)phenyl]methanamine
CID 79985784
(S)-(4-ethylphenyl)-thiophen-3-ylmethanamine
CID 171211233
(3-ethylthiophen-2-yl)-(3-propan-2-yloxyphenyl)methanamine
CID 105018973
(4-chloro-3-methoxyphenyl)-(3-ethylthiophen-2-yl)methanamine
CID 105006834
(3-ethylthiophen-2-yl)-(2,4,5-trifluorophenyl)methanamine
CID 103301726
(3-ethylthiophen-2-yl)-(2-fluorophenyl)methanamine
CID 115827861
(3-cyclobutylphenyl)-(3-ethylthiophen-2-yl)methanamine
CID 105053637
1-(3-ethylthiophen-2-yl)prop-2-yn-1-amine
CID 104995454
(3-ethylthiophen-2-yl)-(1-methylpyrazol-3-yl)methanamine
CID 103134660

Frequently Asked Questions

What is the IUPAC name of (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine?
The IUPAC name of (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine (CID 104988308) is (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine?
The canonical SMILES for (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine is CCc1ccsc1C(N)c1ccsc1.
What is the InChIKey of (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine?
The InChIKey is DNYGEEPHJYDETR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NS2/c1-2-8-4-6-14-11(8)10(12)9-3-5-13-7-9/h3-7,10H,2,12H2,1H3.
What are the key properties of (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine?
(3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine has a molecular weight of 223.37 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylthiophen-2-yl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 104988308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).