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

C15H28N4 — CID 106567072

IUPAC4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(CC2CCN(C)CC2)c(NCC(C)C)n1
InChIInChI=1S/C15H28N4/c1-12(2)9-16-15-17-13(3)10-19(15)11-14-5-7-18(4)8-6-14/h10,12,14H,5-9,11H2,1-4H3,(H,16,17)
InChIKeyDMGIIXWOAXGVCJ-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.60
Rot. Bonds5

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

4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 106567072) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine
PubChem CID106567072
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(CC2CCN(C)CC2)c(NCC(C)C)n1
InChIInChI=1S/C15H28N4/c1-12(2)9-16-15-17-13(3)10-19(15)11-14-5-7-18(4)8-6-14/h10,12,14H,5-9,11H2,1-4H3,(H,16,17)
InChIKeyDMGIIXWOAXGVCJ-UHFFFAOYSA-N
XLogP2.60
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine (CID 106567072) is 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine is Cc1cn(CC2CCN(C)CC2)c(NCC(C)C)n1.
What is the InChIKey of 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is DMGIIXWOAXGVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-12(2)9-16-15-17-13(3)10-19(15)11-14-5-7-18(4)8-6-14/h10,12,14H,5-9,11H2,1-4H3,(H,16,17).
What are the key properties of 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine?
4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106567072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).