N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine

C11H20N4 — CID 106551810

IUPACN-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine
SMILESCc1cn(C)c(N(C)C2CCCNC2)n1
InChIInChI=1S/C11H20N4/c1-9-8-14(2)11(13-9)15(3)10-5-4-6-12-7-10/h8,10,12H,4-7H2,1-3H3
InChIKeyYMWCGABEYYYGDP-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.92
Rot. Bonds2

About N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine

N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine (PubChem CID 106551810) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine
PubChem CID106551810
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine
SMILESCc1cn(C)c(N(C)C2CCCNC2)n1
InChIInChI=1S/C11H20N4/c1-9-8-14(2)11(13-9)15(3)10-5-4-6-12-7-10/h8,10,12H,4-7H2,1-3H3
InChIKeyYMWCGABEYYYGDP-UHFFFAOYSA-N
XLogP0.92
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine?
The IUPAC name of N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine (CID 106551810) is N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine.
What is the SMILES notation for N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine?
The canonical SMILES for N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine is Cc1cn(C)c(N(C)C2CCCNC2)n1.
What is the InChIKey of N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine?
The InChIKey is YMWCGABEYYYGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-9-8-14(2)11(13-9)15(3)10-5-4-6-12-7-10/h8,10,12H,4-7H2,1-3H3.
What are the key properties of N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine?
N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dimethylimidazol-2-yl)-N-methylpiperidin-3-amine is sourced from PubChem (CID 106551810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).