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

C14H15N3S — CID 79505674

IUPAC1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2C(N)=NCC2c2cccs2)c1
InChIInChI=1S/C14H15N3S/c1-10-4-2-5-11(8-10)17-12(9-16-14(17)15)13-6-3-7-18-13/h2-8,12H,9H2,1H3,(H2,15,16)
InChIKeyQSSRHRUJRRQQDT-UHFFFAOYSA-N
MW257.36 g/mol
LogP2.93
Rot. Bonds2

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

1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine (PubChem CID 79505674) has the molecular formula C14H15N3S and a molecular weight of 257.36 g/mol. Its IUPAC name is 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
PubChem CID79505674
Molecular FormulaC14H15N3S
Molecular Weight257.36 g/mol
Exact Mass257.10
IUPAC Name1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2C(N)=NCC2c2cccs2)c1
InChIInChI=1S/C14H15N3S/c1-10-4-2-5-11(8-10)17-12(9-16-14(17)15)13-6-3-7-18-13/h2-8,12H,9H2,1H3,(H2,15,16)
InChIKeyQSSRHRUJRRQQDT-UHFFFAOYSA-N
XLogP2.93
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(5-ethylthiophen-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505068
5-methyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79504921
5-(5-chloro-1,3-thiazol-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 107126041
5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 114867764
5-(3-cyclopropylimidazol-4-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79499329
5-(4-bromothiophen-2-yl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505173
1-(3-bromophenyl)-5-(3-bromothiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 115381645
1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79502172
1-(3-chlorophenyl)-5-(4-methyl-1,3-thiazol-2-yl)-4,5-dihydroimidazol-2-amine
CID 104772259
5-hexyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505143
1-(3-bromophenyl)-5-(5-ethylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79515008
5-(5-bromothiophen-2-yl)-1-(3-chlorophenyl)-4,5-dihydroimidazol-2-amine
CID 79504982

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine (CID 79505674) is 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine is Cc1cccc(N2C(N)=NCC2c2cccs2)c1.
What is the InChIKey of 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine?
The InChIKey is QSSRHRUJRRQQDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3S/c1-10-4-2-5-11(8-10)17-12(9-16-14(17)15)13-6-3-7-18-13/h2-8,12H,9H2,1H3,(H2,15,16).
What are the key properties of 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine?
1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine has a molecular weight of 257.36 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79505674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).