N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine

C11H20N4 — CID 167103021

IUPACN,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine
SMILESCN(C)c1cn(CC2CCNCC2)cn1
InChIInChI=1S/C11H20N4/c1-14(2)11-8-15(9-13-11)7-10-3-5-12-6-4-10/h8-10,12H,3-7H2,1-2H3
InChIKeyCWSIXMMPVCUZIE-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.95
Rot. Bonds3

About N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine

N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine (PubChem CID 167103021) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine
PubChem CID167103021
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine
SMILESCN(C)c1cn(CC2CCNCC2)cn1
InChIInChI=1S/C11H20N4/c1-14(2)11-8-15(9-13-11)7-10-3-5-12-6-4-10/h8-10,12H,3-7H2,1-2H3
InChIKeyCWSIXMMPVCUZIE-UHFFFAOYSA-N
XLogP0.95
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine?
The IUPAC name of N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine (CID 167103021) is N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine.
What is the SMILES notation for N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine?
The canonical SMILES for N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine is CN(C)c1cn(CC2CCNCC2)cn1.
What is the InChIKey of N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine?
The InChIKey is CWSIXMMPVCUZIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-14(2)11-8-15(9-13-11)7-10-3-5-12-6-4-10/h8-10,12H,3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine?
N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine has a molecular weight of 208.31 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(piperidin-4-ylmethyl)imidazol-4-amine is sourced from PubChem (CID 167103021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).