1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine

C16H20ClN3 — CID 106556315

IUPAC1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
SMILESCc1c(Cl)cccc1-n1ccnc1NC1CCCCC1
InChIInChI=1S/C16H20ClN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyXFNKULGTELPCHP-UHFFFAOYSA-N
MW289.81 g/mol
LogP4.58
Rot. Bonds3

About 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine

1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine (PubChem CID 106556315) has the molecular formula C16H20ClN3 and a molecular weight of 289.81 g/mol. Its IUPAC name is 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine.

Molecular Properties

Compound Name1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
PubChem CID106556315
Molecular FormulaC16H20ClN3
Molecular Weight289.81 g/mol
Exact Mass289.13
IUPAC Name1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
SMILESCc1c(Cl)cccc1-n1ccnc1NC1CCCCC1
InChIInChI=1S/C16H20ClN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyXFNKULGTELPCHP-UHFFFAOYSA-N
XLogP4.58
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-N-cyclohexylimidazol-2-amine
CID 106558771
N-cyclohexyl-1-(2,3-dichlorophenyl)imidazol-2-amine
CID 106560318
N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine
CID 106564061
1-(5-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
CID 106560628
1-(2-chloro-5-methoxyphenyl)-N-cyclohexylimidazol-2-amine
CID 106564006
1-(2-chloro-4-fluorophenyl)-N-cyclopentylimidazol-2-amine
CID 106554110
N-cyclohexyl-1-(2,5-dimethylphenyl)imidazol-2-amine
CID 106558241
N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
N-cycloheptyl-1-phenylimidazol-2-amine
CID 106561276
3-chloro-N-cyclohexyl-2-methylaniline
CID 29276475
1-(4-chloro-3-methoxyphenyl)-N-cyclohexylimidazol-2-amine
CID 107623823
1-(2-chloro-5-iodophenyl)-N-cyclopropylimidazol-2-amine
CID 114261820

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine?
The IUPAC name of 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine (CID 106556315) is 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine.
What is the SMILES notation for 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine?
The canonical SMILES for 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine is Cc1c(Cl)cccc1-n1ccnc1NC1CCCCC1.
What is the InChIKey of 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine?
The InChIKey is XFNKULGTELPCHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19).
What are the key properties of 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine?
1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine has a molecular weight of 289.81 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine is sourced from PubChem (CID 106556315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).