(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine

C11H13NS2 — CID 43464505

IUPAC(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine
SMILESCc1cc(C(N)c2ccsc2)c(C)s1
InChIInChI=1S/C11H13NS2/c1-7-5-10(8(2)14-7)11(12)9-3-4-13-6-9/h3-6,11H,12H2,1-2H3
InChIKeyKMUYSUXZOKFVBJ-UHFFFAOYSA-N
MW223.37 g/mol
LogP3.47
Rot. Bonds2

About (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine

(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine (PubChem CID 43464505) has the molecular formula C11H13NS2 and a molecular weight of 223.37 g/mol. Its IUPAC name is (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine
PubChem CID43464505
Molecular FormulaC11H13NS2
Molecular Weight223.37 g/mol
Exact Mass223.05
IUPAC Name(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine
SMILESCc1cc(C(N)c2ccsc2)c(C)s1
InChIInChI=1S/C11H13NS2/c1-7-5-10(8(2)14-7)11(12)9-3-4-13-6-9/h3-6,11H,12H2,1-2H3
InChIKeyKMUYSUXZOKFVBJ-UHFFFAOYSA-N
XLogP3.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[bromo(thiophen-3-yl)methyl]-2,5-dimethylthiophene
CID 61098752
(2,5-dimethylthiophen-3-yl)-(4-iodophenyl)methanamine
CID 43124905
(R)-(2,4-dimethylphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171232778
(3,4-difluorophenyl)-(2,5-dimethylthiophen-3-yl)methanamine
CID 43119710
(2,5-dimethylthiophen-3-yl)-thiophen-2-ylmethanamine
CID 43464516
(S)-(2-bromo-4-methylphenyl)-thiophen-3-ylmethanamine
CID 171221689
2-[(S)-amino(thiophen-3-yl)methyl]-4-methylphenol
CID 171202323
(3-chlorothiophen-2-yl)-(2,5-dimethylthiophen-3-yl)methanamine
CID 80645040
(3-ethyl-6-methylpyridazin-4-yl)-thiophen-3-ylmethanamine
CID 105154023
(4,5-dimethoxy-2-methylphenyl)-thiophen-3-ylmethanamine
CID 43626602
(S)-thiophen-3-yl-(2,4,5-trifluorophenyl)methanamine
CID 171209924
(S)-(5-bromo-2-fluoro-3-methylphenyl)-thiophen-3-ylmethanamine
CID 171204987

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine?
The IUPAC name of (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine (CID 43464505) is (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine?
The canonical SMILES for (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine is Cc1cc(C(N)c2ccsc2)c(C)s1.
What is the InChIKey of (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine?
The InChIKey is KMUYSUXZOKFVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NS2/c1-7-5-10(8(2)14-7)11(12)9-3-4-13-6-9/h3-6,11H,12H2,1-2H3.
What are the key properties of (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine?
(2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine has a molecular weight of 223.37 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylthiophen-3-yl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 43464505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).