[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine

C17H30N4 — CID 106552867

IUPAC[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine
SMILESCc1cn(C2CCCCC2)c(N2CC(CN)CCC2C)n1
InChIInChI=1S/C17H30N4/c1-13-11-21(16-6-4-3-5-7-16)17(19-13)20-12-15(10-18)9-8-14(20)2/h11,14-16H,3-10,12,18H2,1-2H3
InChIKeyFOPUWNDXHHESFV-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.26
Rot. Bonds3

About [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine

[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine (PubChem CID 106552867) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine
PubChem CID106552867
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine
SMILESCc1cn(C2CCCCC2)c(N2CC(CN)CCC2C)n1
InChIInChI=1S/C17H30N4/c1-13-11-21(16-6-4-3-5-7-16)17(19-13)20-12-15(10-18)9-8-14(20)2/h11,14-16H,3-10,12,18H2,1-2H3
InChIKeyFOPUWNDXHHESFV-UHFFFAOYSA-N
XLogP3.26
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine?
The IUPAC name of [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine (CID 106552867) is [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine.
What is the SMILES notation for [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine?
The canonical SMILES for [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine is Cc1cn(C2CCCCC2)c(N2CC(CN)CCC2C)n1.
What is the InChIKey of [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine?
The InChIKey is FOPUWNDXHHESFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-13-11-21(16-6-4-3-5-7-16)17(19-13)20-12-15(10-18)9-8-14(20)2/h11,14-16H,3-10,12,18H2,1-2H3.
What are the key properties of [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine?
[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine has a molecular weight of 290.45 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine is sourced from PubChem (CID 106552867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).