5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

C16H19N3S — CID 79505068

IUPAC5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCCc1ccc(C2CN=C(N)N2c2cccc(C)c2)s1
InChIInChI=1S/C16H19N3S/c1-3-13-7-8-15(20-13)14-10-18-16(17)19(14)12-6-4-5-11(2)9-12/h4-9,14H,3,10H2,1-2H3,(H2,17,18)
InChIKeyTVWGTVVHBLRJTP-UHFFFAOYSA-N
MW285.42 g/mol
LogP3.49
Rot. Bonds3

About 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79505068) has the molecular formula C16H19N3S and a molecular weight of 285.42 g/mol. Its IUPAC name is 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79505068
Molecular FormulaC16H19N3S
Molecular Weight285.42 g/mol
Exact Mass285.13
IUPAC Name5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCCc1ccc(C2CN=C(N)N2c2cccc(C)c2)s1
InChIInChI=1S/C16H19N3S/c1-3-13-7-8-15(20-13)14-10-18-16(17)19(14)12-6-4-5-11(2)9-12/h4-9,14H,3,10H2,1-2H3,(H2,17,18)
InChIKeyTVWGTVVHBLRJTP-UHFFFAOYSA-N
XLogP3.49
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.42
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 79505068) is 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is CCc1ccc(C2CN=C(N)N2c2cccc(C)c2)s1.
What is the InChIKey of 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is TVWGTVVHBLRJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3S/c1-3-13-7-8-15(20-13)14-10-18-16(17)19(14)12-6-4-5-11(2)9-12/h4-9,14H,3,10H2,1-2H3,(H2,17,18).
What are the key properties of 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 285.42 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79505068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).