N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine

C13H24N4 — CID 83007196

IUPACN-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine
SMILESCCn1cncc1CNN1C(C)CCCC1C
InChIInChI=1S/C13H24N4/c1-4-16-10-14-8-13(16)9-15-17-11(2)6-5-7-12(17)3/h8,10-12,15H,4-7,9H2,1-3H3
InChIKeyZVONBPIEHJDXKX-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.17
Rot. Bonds4

About N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine

N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine (PubChem CID 83007196) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine
PubChem CID83007196
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine
SMILESCCn1cncc1CNN1C(C)CCCC1C
InChIInChI=1S/C13H24N4/c1-4-16-10-14-8-13(16)9-15-17-11(2)6-5-7-12(17)3/h8,10-12,15H,4-7,9H2,1-3H3
InChIKeyZVONBPIEHJDXKX-UHFFFAOYSA-N
XLogP2.17
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine
CID 83007117
N-[(3-ethylimidazol-4-yl)methyl]-2-methylcyclopropan-1-amine
CID 66135498
3-[[(3-ethylimidazol-4-yl)methylamino]methyl]cyclohexan-1-ol
CID 106123181
2,6-dimethyl-N-(pyrimidin-5-ylmethyl)piperidin-1-amine
CID 83006721
N-[(3-ethylimidazol-4-yl)methyl]-1-(4-methylcyclohexyl)methanamine
CID 66133237
N-[(3-ethylimidazol-4-yl)methyl]propan-2-amine
CID 66118230
N-[(3-ethylimidazol-4-yl)methyl]morpholin-4-amine
CID 83008990
2-cyclohexyl-N-[(3-ethylimidazol-4-yl)methyl]ethanamine
CID 66135055
N-[(3-ethylimidazol-4-yl)methyl]-1-(1-methylpyrrolidin-3-yl)methanamine
CID 66133411
3-cyclopentyl-N-[(3-ethylimidazol-4-yl)methyl]propan-1-amine
CID 106008076
3-[(3-ethylimidazol-4-yl)methylamino]azepan-2-one
CID 66132755
N-[(3-ethylimidazol-4-yl)methyl]-1,1-dioxothiolan-3-amine
CID 66118433

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine (CID 83007196) is N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine is CCn1cncc1CNN1C(C)CCCC1C.
What is the InChIKey of N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine?
The InChIKey is ZVONBPIEHJDXKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-16-10-14-8-13(16)9-15-17-11(2)6-5-7-12(17)3/h8,10-12,15H,4-7,9H2,1-3H3.
What are the key properties of N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine?
N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine has a molecular weight of 236.36 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylimidazol-4-yl)methyl]-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83007196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).