N-(2-chlorophenyl)-1-ethylimidazol-2-amine

C11H12ClN3 — CID 106558776

IUPACN-(2-chlorophenyl)-1-ethylimidazol-2-amine
SMILESCCn1ccnc1Nc1ccccc1Cl
InChIInChI=1S/C11H12ClN3/c1-2-15-8-7-13-11(15)14-10-6-4-3-5-9(10)12/h3-8H,2H2,1H3,(H,13,14)
InChIKeyNJMAEZIBXIHSCZ-UHFFFAOYSA-N
MW221.69 g/mol
LogP3.30
Rot. Bonds3

About N-(2-chlorophenyl)-1-ethylimidazol-2-amine

N-(2-chlorophenyl)-1-ethylimidazol-2-amine (PubChem CID 106558776) has the molecular formula C11H12ClN3 and a molecular weight of 221.69 g/mol. Its IUPAC name is N-(2-chlorophenyl)-1-ethylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)-1-ethylimidazol-2-amine
PubChem CID106558776
Molecular FormulaC11H12ClN3
Molecular Weight221.69 g/mol
Exact Mass221.07
IUPAC NameN-(2-chlorophenyl)-1-ethylimidazol-2-amine
SMILESCCn1ccnc1Nc1ccccc1Cl
InChIInChI=1S/C11H12ClN3/c1-2-15-8-7-13-11(15)14-10-6-4-3-5-9(10)12/h3-8H,2H2,1H3,(H,13,14)
InChIKeyNJMAEZIBXIHSCZ-UHFFFAOYSA-N
XLogP3.30
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.69
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-chlorophenyl)-1-ethylimidazol-2-amine
CID 106571125
N-[(2-chlorophenyl)methyl]-1-ethylimidazol-2-amine
CID 62136767
N-(4-bromo-2,3-dichlorophenyl)-1-ethylimidazol-2-amine
CID 114002339
N-(2,3-dichlorophenyl)-1-(3-ethoxypropyl)imidazol-2-amine
CID 106560302
N-(4-bromo-3-chlorophenyl)-1-ethylimidazol-2-amine
CID 107618236
1-(1-(213C)ethylimidazol-2-yl)-2-phenylhydrazine
CID 102512179
N-(2-chloro-5-fluorophenyl)-1-propylimidazol-2-amine
CID 107532048
N-(2-bromo-4-methylphenyl)-1-ethylimidazol-2-amine
CID 106555659
N-(2,3-dichlorophenyl)-1-ethyl-4-methylimidazol-2-amine
CID 106560336
1-butyl-N-(2-chloro-4-iodophenyl)imidazol-2-amine
CID 107605158
N-(2,4-dichlorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106556363
1-butyl-N-(2-propylphenyl)imidazol-2-amine
CID 106567389

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-1-ethylimidazol-2-amine?
The IUPAC name of N-(2-chlorophenyl)-1-ethylimidazol-2-amine (CID 106558776) is N-(2-chlorophenyl)-1-ethylimidazol-2-amine.
What is the SMILES notation for N-(2-chlorophenyl)-1-ethylimidazol-2-amine?
The canonical SMILES for N-(2-chlorophenyl)-1-ethylimidazol-2-amine is CCn1ccnc1Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-1-ethylimidazol-2-amine?
The InChIKey is NJMAEZIBXIHSCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3/c1-2-15-8-7-13-11(15)14-10-6-4-3-5-9(10)12/h3-8H,2H2,1H3,(H,13,14).
What are the key properties of N-(2-chlorophenyl)-1-ethylimidazol-2-amine?
N-(2-chlorophenyl)-1-ethylimidazol-2-amine has a molecular weight of 221.69 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-1-ethylimidazol-2-amine is sourced from PubChem (CID 106558776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).