5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine

C17H16ClN3 — CID 63468761

IUPAC5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine
SMILESCCn1c(-c2ccccc2)nc(-c2cccc(Cl)c2)c1N
InChIInChI=1S/C17H16ClN3/c1-2-21-16(19)15(13-9-6-10-14(18)11-13)20-17(21)12-7-4-3-5-8-12/h3-11H,2,19H2,1H3
InChIKeyRAKNCRXYBAAHML-UHFFFAOYSA-N
MW297.79 g/mol
LogP4.47
Rot. Bonds3

About 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine

5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine (PubChem CID 63468761) has the molecular formula C17H16ClN3 and a molecular weight of 297.79 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine.

Molecular Properties

Compound Name5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine
PubChem CID63468761
Molecular FormulaC17H16ClN3
Molecular Weight297.79 g/mol
Exact Mass297.10
IUPAC Name5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine
SMILESCCn1c(-c2ccccc2)nc(-c2cccc(Cl)c2)c1N
InChIInChI=1S/C17H16ClN3/c1-2-21-16(19)15(13-9-6-10-14(18)11-13)20-17(21)12-7-4-3-5-8-12/h3-11H,2,19H2,1H3
InChIKeyRAKNCRXYBAAHML-UHFFFAOYSA-N
XLogP4.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine
CID 62222262
5-(3-chlorophenyl)-2-ethyl-3-methylimidazol-4-amine
CID 62226374
4-(3-chlorophenyl)-2-ethylimidazole-1,5-diamine
CID 62483208
2,3-diethyl-5-(3-methylphenyl)imidazol-4-amine
CID 62225267
5-(3-chlorophenyl)-2-ethyl-3-propan-2-ylimidazol-4-amine
CID 55048633
3-tert-butyl-5-(3-chlorophenyl)-2-ethylimidazol-4-amine
CID 62220448
3-ethyl-5-(3-methylphenyl)-2-propan-2-ylimidazol-4-amine
CID 62220327
2-tert-butyl-3-ethyl-5-(3-methylphenyl)imidazol-4-amine
CID 62218997
5-(3,5-dichlorophenyl)-2,3-diethylimidazol-4-amine
CID 62226580
2-methyl-5-phenyl-3-prop-2-ynylimidazol-4-amine
CID 53275789
2-(3-chlorophenyl)-1-ethylpyrrolo[3,2-b]pyridin-5-amine
CID 118466453
2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol
CID 69299704

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine?
The IUPAC name of 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine (CID 63468761) is 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine.
What is the SMILES notation for 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine?
The canonical SMILES for 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine is CCn1c(-c2ccccc2)nc(-c2cccc(Cl)c2)c1N.
What is the InChIKey of 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine?
The InChIKey is RAKNCRXYBAAHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3/c1-2-21-16(19)15(13-9-6-10-14(18)11-13)20-17(21)12-7-4-3-5-8-12/h3-11H,2,19H2,1H3.
What are the key properties of 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine?
5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine has a molecular weight of 297.79 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-3-ethyl-2-phenylimidazol-4-amine is sourced from PubChem (CID 63468761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).