N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine

C15H17N3S2 — CID 56745066

IUPACN,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine
SMILESCN(C)Cc1csc(-c2nccn2Cc2ccsc2)c1
InChIInChI=1S/C15H17N3S2/c1-17(2)8-13-7-14(20-11-13)15-16-4-5-18(15)9-12-3-6-19-10-12/h3-7,10-11H,8-9H2,1-2H3
InChIKeyZBSKCKVNNLDYGR-UHFFFAOYSA-N
MW303.46 g/mol
LogP3.78
Rot. Bonds5

About N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine

N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine (PubChem CID 56745066) has the molecular formula C15H17N3S2 and a molecular weight of 303.46 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine
PubChem CID56745066
Molecular FormulaC15H17N3S2
Molecular Weight303.46 g/mol
Exact Mass303.09
IUPAC NameN,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine
SMILESCN(C)Cc1csc(-c2nccn2Cc2ccsc2)c1
InChIInChI=1S/C15H17N3S2/c1-17(2)8-13-7-14(20-11-13)15-16-4-5-18(15)9-12-3-6-19-10-12/h3-7,10-11H,8-9H2,1-2H3
InChIKeyZBSKCKVNNLDYGR-UHFFFAOYSA-N
XLogP3.78
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.46
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(4-methylphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539905
4-(2-Thienyl)-1-(4-Methylbenzyl)-1h-Imidazole
CID 446185
1-methyl-4-(thiophen-3-yl)-1H-imidazole
CID 6539906
1-((4-phenylthiophen-2-yl)methyl)-1H-imidazole
CID 44455927
1-(5-Phenyl-thiophen-2-ylmethyl)-1H-imidazole
CID 53319147
N-[2-(1-benzylimidazol-2-yl)ethyl]-1-thiophen-3-ylethanamine
CID 75382647
1,3-dimethyl-2-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]imidazol-1-ium iodide
CID 46906861
N-[2-(1-benzylimidazol-2-yl)ethyl]-1-thiophen-2-ylethanamine
CID 71916239
5-[[3-imidazol-1-ylpropyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N,N-dimethylpyrimidin-2-amine
CID 16676765
3-imidazol-1-yl-N-[(5-methylthiophen-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-1-amine
CID 16676786
1-[[4-(5-Methylsulfanylthiophen-2-yl)phenyl]methyl]imidazole
CID 44456303
(2-methoxyethyl){[1-(2-methoxyethyl)-1H-imidazol-2-yl]methyl}[(3-methyl-2-thienyl)methyl]amine
CID 46986746

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine (CID 56745066) is N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine is CN(C)Cc1csc(-c2nccn2Cc2ccsc2)c1.
What is the InChIKey of N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine?
The InChIKey is ZBSKCKVNNLDYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3S2/c1-17(2)8-13-7-14(20-11-13)15-16-4-5-18(15)9-12-3-6-19-10-12/h3-7,10-11H,8-9H2,1-2H3.
What are the key properties of N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine?
N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine has a molecular weight of 303.46 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-[1-(thiophen-3-ylmethyl)imidazol-2-yl]thiophen-3-yl]methanamine is sourced from PubChem (CID 56745066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).