(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine

C9H10N2S2 — CID 62403368

IUPAC(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
SMILESCc1nc(-c2ccsc2)sc1CN
InChIInChI=1S/C9H10N2S2/c1-6-8(4-10)13-9(11-6)7-2-3-12-5-7/h2-3,5H,4,10H2,1H3
InChIKeyGPYILVYQJBGOEZ-UHFFFAOYSA-N
MW210.33 g/mol
LogP2.64
Rot. Bonds2

About (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine

(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine (PubChem CID 62403368) has the molecular formula C9H10N2S2 and a molecular weight of 210.33 g/mol. Its IUPAC name is (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
PubChem CID62403368
Molecular FormulaC9H10N2S2
Molecular Weight210.33 g/mol
Exact Mass210.03
IUPAC Name(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
SMILESCc1nc(-c2ccsc2)sc1CN
InChIInChI=1S/C9H10N2S2/c1-6-8(4-10)13-9(11-6)7-2-3-12-5-7/h2-3,5H,4,10H2,1H3
InChIKeyGPYILVYQJBGOEZ-UHFFFAOYSA-N
XLogP2.64
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-{[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]methyl}piperazine
CID 16227456
1-(2-(Thiophen-3-yl)-1,3-thiazol-4-yl)methanamine dihydrochloride
CID 165993978
1-[(3R)-1-ethylpyrrolidin-3-yl]-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]methanamine
CID 97028745
[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]methanamine
CID 60672525
1,1,1-Trifluoro-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)propan-2-amine
CID 113461182
N-[[2-thiophen-3-yl-4-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 113497297
2,2,2-trifluoro-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 115574424
3-fluoro-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]propan-1-amine
CID 115732902
3-fluoro-N-[(2-thiophen-3-yl-1,3-thiazol-5-yl)methyl]propan-1-amine
CID 115732946
[2-Thiophen-3-yl-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 116276786
[2-(4-Methylthiophen-3-yl)-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 116276802
N-methyl-1-[2-thiophen-3-yl-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 116276997

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine (CID 62403368) is (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine is Cc1nc(-c2ccsc2)sc1CN.
What is the InChIKey of (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The InChIKey is GPYILVYQJBGOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S2/c1-6-8(4-10)13-9(11-6)7-2-3-12-5-7/h2-3,5H,4,10H2,1H3.
What are the key properties of (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine has a molecular weight of 210.33 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 62403368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).