N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine

C12H22N4 — CID 114703731

IUPACN,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine
SMILESCN(C)CCn1cncc1C1CCCNC1
InChIInChI=1S/C12H22N4/c1-15(2)6-7-16-10-14-9-12(16)11-4-3-5-13-8-11/h9-11,13H,3-8H2,1-2H3
InChIKeyGWKSBYGKYDEGMK-UHFFFAOYSA-N
MW222.34 g/mol
LogP0.91
Rot. Bonds4

About N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine

N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine (PubChem CID 114703731) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine
PubChem CID114703731
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine
SMILESCN(C)CCn1cncc1C1CCCNC1
InChIInChI=1S/C12H22N4/c1-15(2)6-7-16-10-14-9-12(16)11-4-3-5-13-8-11/h9-11,13H,3-8H2,1-2H3
InChIKeyGWKSBYGKYDEGMK-UHFFFAOYSA-N
XLogP0.91
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-butylimidazol-4-yl)piperidine
CID 114702793
N,N-dimethyl-1-(5-piperidin-3-ylimidazol-1-yl)propan-2-amine
CID 114704884
1-[2-(5-piperidin-3-ylimidazol-1-yl)ethyl]piperidine
CID 114704706
3-[3-(3-methyl-2-propan-2-ylbutyl)imidazol-4-yl]piperidine
CID 102909112
3-[3-[2-(4-fluorophenyl)ethyl]imidazol-4-yl]piperidine
CID 114703121
3-[3-(4-propan-2-yloxybutyl)imidazol-4-yl]piperidine
CID 106009447
3-[3-[2-(4-chlorophenyl)ethyl]imidazol-4-yl]piperidine
CID 114704865
3-[3-[(2-bromophenyl)methyl]imidazol-4-yl]piperidine
CID 114704979
3-[3-(2,2-dicyclopropylethyl)imidazol-4-yl]piperidine
CID 114706511
3-[3-[(2-methylpyrazol-3-yl)methyl]imidazol-4-yl]piperidine
CID 114706130
1-butyl-5-pyrrolidin-3-ylimidazole
CID 114716363
1-(2-cyclobutylethyl)-5-pyrrolidin-3-ylimidazole
CID 114722227

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine (CID 114703731) is N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine is CN(C)CCn1cncc1C1CCCNC1.
What is the InChIKey of N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine?
The InChIKey is GWKSBYGKYDEGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-15(2)6-7-16-10-14-9-12(16)11-4-3-5-13-8-11/h9-11,13H,3-8H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine?
N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine has a molecular weight of 222.34 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(5-piperidin-3-ylimidazol-1-yl)ethanamine is sourced from PubChem (CID 114703731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).