1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine

C11H14N2S2 — CID 65243899

IUPAC1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESCc1cc(CNCc2nccs2)sc1C
InChIInChI=1S/C11H14N2S2/c1-8-5-10(15-9(8)2)6-12-7-11-13-3-4-14-11/h3-5,12H,6-7H2,1-2H3
InChIKeyFTZPQUOCLFOXSJ-UHFFFAOYSA-N
MW238.38 g/mol
LogP3.11
Rot. Bonds4

About 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine

1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (PubChem CID 65243899) has the molecular formula C11H14N2S2 and a molecular weight of 238.38 g/mol. Its IUPAC name is 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
PubChem CID65243899
Molecular FormulaC11H14N2S2
Molecular Weight238.38 g/mol
Exact Mass238.06
IUPAC Name1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESCc1cc(CNCc2nccs2)sc1C
InChIInChI=1S/C11H14N2S2/c1-8-5-10(15-9(8)2)6-12-7-11-13-3-4-14-11/h3-5,12H,6-7H2,1-2H3
InChIKeyFTZPQUOCLFOXSJ-UHFFFAOYSA-N
XLogP3.11
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-bromo-5-methylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 102834932
N-(1,3-thiazol-2-ylmethyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 60961813
N-(1,3-benzothiazol-2-ylmethyl)-1-(4,5-dimethylthiophen-2-yl)methanamine
CID 65243812
N-[(4,5-dimethylthiophen-2-yl)methyl]-1-(5-ethylthiophen-2-yl)methanamine
CID 65246641
N-[(4,5-dimethylthiophen-2-yl)methyl]-2,2,2-trifluoroethanamine
CID 65238850
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-methylpropan-1-amine
CID 65238696
N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
CID 65245920
1-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 63378422
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-thiophen-2-ylethanamine
CID 65244071
N'-[(4,5-dimethylthiophen-2-yl)methyl]-N-prop-2-enylethane-1,2-diamine
CID 79280270
1-(2-methyl-1,3-thiazol-4-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 60961012
1-(4,5-dimethylthiophen-2-yl)-N-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)methanamine
CID 66415887

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (CID 65243899) is 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The canonical SMILES for 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is Cc1cc(CNCc2nccs2)sc1C.
What is the InChIKey of 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The InChIKey is FTZPQUOCLFOXSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S2/c1-8-5-10(15-9(8)2)6-12-7-11-13-3-4-14-11/h3-5,12H,6-7H2,1-2H3.
What are the key properties of 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine has a molecular weight of 238.38 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethylthiophen-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is sourced from PubChem (CID 65243899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).