1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine

C17H30N4 — CID 106565250

IUPAC1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCC2CCCCN2C)n1
InChIInChI=1S/C17H30N4/c1-14-13-21(15-8-4-3-5-9-15)17(19-14)18-12-16-10-6-7-11-20(16)2/h13,15-16H,3-12H2,1-2H3,(H,18,19)
InChIKeyACQRDLRQUFBOGW-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.59
Rot. Bonds4

About 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine

1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine (PubChem CID 106565250) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
PubChem CID106565250
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCC2CCCCN2C)n1
InChIInChI=1S/C17H30N4/c1-14-13-21(15-8-4-3-5-9-15)17(19-14)18-12-16-10-6-7-11-20(16)2/h13,15-16H,3-12H2,1-2H3,(H,18,19)
InChIKeyACQRDLRQUFBOGW-UHFFFAOYSA-N
XLogP3.59
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine (CID 106565250) is 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine is Cc1cn(C2CCCCC2)c(NCC2CCCCN2C)n1.
What is the InChIKey of 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The InChIKey is ACQRDLRQUFBOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-14-13-21(15-8-4-3-5-9-15)17(19-14)18-12-16-10-6-7-11-20(16)2/h13,15-16H,3-12H2,1-2H3,(H,18,19).
What are the key properties of 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine has a molecular weight of 290.45 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106565250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).