1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine

C16H20ClN3O — CID 106564006

IUPAC1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine
SMILESCOc1ccc(Cl)c(-n2ccnc2NC2CCCCC2)c1
InChIInChI=1S/C16H20ClN3O/c1-21-13-7-8-14(17)15(11-13)20-10-9-18-16(20)19-12-5-3-2-4-6-12/h7-12H,2-6H2,1H3,(H,18,19)
InChIKeyOTKOPKVCVREPMF-UHFFFAOYSA-N
MW305.81 g/mol
LogP4.28
Rot. Bonds4

About 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine

1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine (PubChem CID 106564006) has the molecular formula C16H20ClN3O and a molecular weight of 305.81 g/mol. Its IUPAC name is 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine.

Molecular Properties

Compound Name1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine
PubChem CID106564006
Molecular FormulaC16H20ClN3O
Molecular Weight305.81 g/mol
Exact Mass305.13
IUPAC Name1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine
SMILESCOc1ccc(Cl)c(-n2ccnc2NC2CCCCC2)c1
InChIInChI=1S/C16H20ClN3O/c1-21-13-7-8-14(17)15(11-13)20-10-9-18-16(20)19-12-5-3-2-4-6-12/h7-12H,2-6H2,1H3,(H,18,19)
InChIKeyOTKOPKVCVREPMF-UHFFFAOYSA-N
XLogP4.28
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.81
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-chlorophenyl)-N-cyclohexylimidazol-2-amine
CID 106558771
1-(4-chloro-3-methoxyphenyl)-N-cyclohexylimidazol-2-amine
CID 107623823
1-(2-chloro-5-iodophenyl)-N-cyclopropylimidazol-2-amine
CID 114261820
1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
CID 106556315
1-(5-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
CID 106560628
1-(2-chloro-4-fluorophenyl)-N-cyclopentylimidazol-2-amine
CID 106554110
N-cyclohexyl-1-(2,3-dichlorophenyl)imidazol-2-amine
CID 106560318
N-cyclohexyl-1-(2,5-dimethylphenyl)imidazol-2-amine
CID 106558241
N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
CID 106564117
N-cyclopropyl-1-(4-fluoro-2-methoxyphenyl)imidazol-2-amine
CID 106566452
N-cyclopentyl-1-(3,5-dichlorophenyl)imidazol-2-amine
CID 106557230
N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine
CID 106564061

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine?
The IUPAC name of 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine (CID 106564006) is 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine.
What is the SMILES notation for 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine?
The canonical SMILES for 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine is COc1ccc(Cl)c(-n2ccnc2NC2CCCCC2)c1.
What is the InChIKey of 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine?
The InChIKey is OTKOPKVCVREPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O/c1-21-13-7-8-14(17)15(11-13)20-10-9-18-16(20)19-12-5-3-2-4-6-12/h7-12H,2-6H2,1H3,(H,18,19).
What are the key properties of 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine?
1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine has a molecular weight of 305.81 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine is sourced from PubChem (CID 106564006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).