1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine

C12H22N4 — CID 106552921

IUPAC1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
SMILESCCc1cnc(N2CCCCC2CNC)[nH]1
InChIInChI=1S/C12H22N4/c1-3-10-8-14-12(15-10)16-7-5-4-6-11(16)9-13-2/h8,11,13H,3-7,9H2,1-2H3,(H,14,15)
InChIKeyLAMMCHZVTHMQSF-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.55
Rot. Bonds4

About 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine

1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine (PubChem CID 106552921) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
PubChem CID106552921
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
SMILESCCc1cnc(N2CCCCC2CNC)[nH]1
InChIInChI=1S/C12H22N4/c1-3-10-8-14-12(15-10)16-7-5-4-6-11(16)9-13-2/h8,11,13H,3-7,9H2,1-2H3,(H,14,15)
InChIKeyLAMMCHZVTHMQSF-UHFFFAOYSA-N
XLogP1.55
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(4-ethyl-1-propylimidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
CID 106552936
1-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-2-yl]-N-methylmethanamine
CID 79728781
N-methyl-1-[1-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-2-yl]methanamine
CID 55138849
N-methyl-1-[1-(6-nitro-3-pyridinyl)piperidin-2-yl]methanamine
CID 55167976
1-[1-(4-ethyl-1-prop-2-enylimidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
CID 106552933
N-methyl-1-(1-quinazolin-4-ylpiperidin-2-yl)methanamine
CID 62586937
N-methyl-1-[1-(1-prop-2-enylimidazol-2-yl)piperidin-2-yl]methanamine
CID 106552927
N-methyl-1-(1-thieno[3,2-d]pyrimidin-4-ylpiperidin-2-yl)methanamine
CID 62585668
N-methyl-1-[1-(6-propan-2-yloxypyrimidin-4-yl)piperidin-2-yl]methanamine
CID 66331814
N-methyl-1-[1-(tetrazolo[1,5-a]pyrazin-5-yl)piperidin-2-yl]methanamine
CID 62588010
1-[1-(5-bromo-4-methyl-2-pyridinyl)pyrrolidin-2-yl]-N-methylmethanamine
CID 114869612
N-methyl-1-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]methanamine
CID 102686844

Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine (CID 106552921) is 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine is CCc1cnc(N2CCCCC2CNC)[nH]1.
What is the InChIKey of 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine?
The InChIKey is LAMMCHZVTHMQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-3-10-8-14-12(15-10)16-7-5-4-6-11(16)9-13-2/h8,11,13H,3-7,9H2,1-2H3,(H,14,15).
What are the key properties of 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine?
1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine has a molecular weight of 222.34 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-ethyl-1H-imidazol-2-yl)piperidin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 106552921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).