N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine

C12H22N4 — CID 83026249

IUPACN-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine
SMILESCCn1ccnc1NN1C(C)CCCC1C
InChIInChI=1S/C12H22N4/c1-4-15-9-8-13-12(15)14-16-10(2)6-5-7-11(16)3/h8-11H,4-7H2,1-3H3,(H,13,14)
InChIKeyPXAONGZCRXDUJS-UHFFFAOYSA-N
MW222.34 g/mol
LogP2.49
Rot. Bonds3

About N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine

N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine (PubChem CID 83026249) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine
PubChem CID83026249
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine
SMILESCCn1ccnc1NN1C(C)CCCC1C
InChIInChI=1S/C12H22N4/c1-4-15-9-8-13-12(15)14-16-10(2)6-5-7-11(16)3/h8-11H,4-7H2,1-3H3,(H,13,14)
InChIKeyPXAONGZCRXDUJS-UHFFFAOYSA-N
XLogP2.49
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine (CID 83026249) is N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine is CCn1ccnc1NN1C(C)CCCC1C.
What is the InChIKey of N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine?
The InChIKey is PXAONGZCRXDUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-4-15-9-8-13-12(15)14-16-10(2)6-5-7-11(16)3/h8-11H,4-7H2,1-3H3,(H,13,14).
What are the key properties of N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine?
N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine has a molecular weight of 222.34 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83026249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).