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

C12H22N4 — CID 135170249

IUPACN-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine
SMILESCNCCn1ccnc1C1CCN(C)CC1
InChIInChI=1S/C12H22N4/c1-13-5-9-16-10-6-14-12(16)11-3-7-15(2)8-4-11/h6,10-11,13H,3-5,7-9H2,1-2H3
InChIKeyOJUUKKZOULMUGY-UHFFFAOYSA-N
MW222.34 g/mol
LogP0.91
Rot. Bonds4

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

N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine (PubChem CID 135170249) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine
PubChem CID135170249
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine
SMILESCNCCn1ccnc1C1CCN(C)CC1
InChIInChI=1S/C12H22N4/c1-13-5-9-16-10-6-14-12(16)11-3-7-15(2)8-4-11/h6,10-11,13H,3-5,7-9H2,1-2H3
InChIKeyOJUUKKZOULMUGY-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

1-methyl-4-[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]piperidine
CID 56861899
4-[1-[(4-fluorophenyl)methyl]imidazol-2-yl]-1-methylpiperidine
CID 56982556
2-cyclopentyl-1-[(1-methylpyrrolidin-3-yl)methyl]imidazole
CID 155911076
N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclopropanecarboxamide
CID 91628946
N-[3-(2-cyclopropylimidazol-1-yl)propyl]-5-methylpyridin-2-amine
CID 70771492
4-[1-[2-(dimethylamino)ethyl]imidazol-2-yl]-N-(2-phenylethyl)piperidine-1-carboxamide
CID 72867590
1-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-(3,4-dimethylphenyl)urea
CID 91628992
4-(1-butylimidazol-2-yl)-1-propan-2-ylsulfonylpiperidine
CID 72924987
(3S)-N-[2-(2-cyclopropylimidazol-1-yl)ethyl]oxolane-3-carboxamide
CID 100681126
N-[2-(2-cyclopropylimidazol-1-yl)ethyl]thiophene-2-sulfonamide
CID 91629003
N-methyl-3-[2-[2-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]propan-1-amine
CID 82559740
1-[4-(1-butylimidazol-2-yl)piperidin-1-yl]-3-[methyl-[(3S)-1-methylpyrrolidin-3-yl]amino]propan-1-one
CID 97269439

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine?
The IUPAC name of N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine (CID 135170249) is N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine?
The canonical SMILES for N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine is CNCCn1ccnc1C1CCN(C)CC1.
What is the InChIKey of N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine?
The InChIKey is OJUUKKZOULMUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-13-5-9-16-10-6-14-12(16)11-3-7-15(2)8-4-11/h6,10-11,13H,3-5,7-9H2,1-2H3.
What are the key properties of N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine?
N-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-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-methyl-2-[2-(1-methylpiperidin-4-yl)imidazol-1-yl]ethanamine is sourced from PubChem (CID 135170249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).