5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine

C13H15N3S2 — CID 79520613

IUPAC5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(C2CN=C(N)N2Cc2cccs2)s1
InChIInChI=1S/C13H15N3S2/c1-9-4-5-12(18-9)11-7-15-13(14)16(11)8-10-3-2-6-17-10/h2-6,11H,7-8H2,1H3,(H2,14,15)
InChIKeyUTTSCDVKOYXFDS-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.99
Rot. Bonds3

About 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine

5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79520613) has the molecular formula C13H15N3S2 and a molecular weight of 277.42 g/mol. Its IUPAC name is 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
PubChem CID79520613
Molecular FormulaC13H15N3S2
Molecular Weight277.42 g/mol
Exact Mass277.07
IUPAC Name5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(C2CN=C(N)N2Cc2cccs2)s1
InChIInChI=1S/C13H15N3S2/c1-9-4-5-12(18-9)11-7-15-13(14)16(11)8-10-3-2-6-17-10/h2-6,11H,7-8H2,1H3,(H2,14,15)
InChIKeyUTTSCDVKOYXFDS-UHFFFAOYSA-N
XLogP2.99
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-ethylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 79520692
5-(4,5-dibromothiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 102845822
5-(4-methyl-1,3-thiazol-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 113451548
5-(2-chlorophenyl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 79521478
5-(5-chloro-1,3-thiazol-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 107126061
5-(4-methoxy-3-methylphenyl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 79501012
1-[2-(diethylamino)ethyl]-5-(5-methylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79515135
1-benzyl-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
CID 79506524
1-butan-2-yl-5-(5-methylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79514595
5-(5-bromothiophen-2-yl)-1-ethyl-4,5-dihydroimidazol-2-amine
CID 79509949
5-(5-ethylthiophen-2-yl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 79509806
1-(oxolan-2-ylmethyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
CID 79505643

Frequently Asked Questions

What is the IUPAC name of 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine (CID 79520613) is 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine is Cc1ccc(C2CN=C(N)N2Cc2cccs2)s1.
What is the InChIKey of 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is UTTSCDVKOYXFDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3S2/c1-9-4-5-12(18-9)11-7-15-13(14)16(11)8-10-3-2-6-17-10/h2-6,11H,7-8H2,1H3,(H2,14,15).
What are the key properties of 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine?
5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 277.42 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methylthiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79520613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).