N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine

C17H23N3O — CID 106564117

IUPACN-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
SMILESCOc1ccc(-n2ccnc2NC2CCCCC2)cc1C
InChIInChI=1S/C17H23N3O/c1-13-12-15(8-9-16(13)21-2)20-11-10-18-17(20)19-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,18,19)
InChIKeyKDRSBBYUMDYOEK-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.93
Rot. Bonds4

About N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine

N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine (PubChem CID 106564117) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
PubChem CID106564117
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
SMILESCOc1ccc(-n2ccnc2NC2CCCCC2)cc1C
InChIInChI=1S/C17H23N3O/c1-13-12-15(8-9-16(13)21-2)20-11-10-18-17(20)19-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,18,19)
InChIKeyKDRSBBYUMDYOEK-UHFFFAOYSA-N
XLogP3.93
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine?
The IUPAC name of N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine (CID 106564117) is N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine.
What is the SMILES notation for N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine?
The canonical SMILES for N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine is COc1ccc(-n2ccnc2NC2CCCCC2)cc1C.
What is the InChIKey of N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine?
The InChIKey is KDRSBBYUMDYOEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-13-12-15(8-9-16(13)21-2)20-11-10-18-17(20)19-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine?
N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine has a molecular weight of 285.39 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine is sourced from PubChem (CID 106564117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).