N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine

C15H28N4O — CID 106553080

IUPACN-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
SMILESCCN(CC1CCNCC1)c1nc(C)cn1CCOC
InChIInChI=1S/C15H28N4O/c1-4-18(12-14-5-7-16-8-6-14)15-17-13(2)11-19(15)9-10-20-3/h11,14,16H,4-10,12H2,1-3H3
InChIKeyNUUBWYRDAKCMLH-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.66
Rot. Bonds7

About N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine

N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine (PubChem CID 106553080) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
PubChem CID106553080
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC NameN-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
SMILESCCN(CC1CCNCC1)c1nc(C)cn1CCOC
InChIInChI=1S/C15H28N4O/c1-4-18(12-14-5-7-16-8-6-14)15-17-13(2)11-19(15)9-10-20-3/h11,14,16H,4-10,12H2,1-3H3
InChIKeyNUUBWYRDAKCMLH-UHFFFAOYSA-N
XLogP1.66
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The IUPAC name of N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine (CID 106553080) is N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine.
What is the SMILES notation for N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The canonical SMILES for N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine is CCN(CC1CCNCC1)c1nc(C)cn1CCOC.
What is the InChIKey of N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The InChIKey is NUUBWYRDAKCMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-4-18(12-14-5-7-16-8-6-14)15-17-13(2)11-19(15)9-10-20-3/h11,14,16H,4-10,12H2,1-3H3.
What are the key properties of N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine has a molecular weight of 280.42 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106553080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).