N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine

C14H26N4O — CID 106617479

IUPACN-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCOCCN(CCc1nccn1C)CC1CCCN1
InChIInChI=1S/C14H26N4O/c1-17-9-7-16-14(17)5-8-18(10-11-19-2)12-13-4-3-6-15-13/h7,9,13,15H,3-6,8,10-12H2,1-2H3
InChIKeyCGPMJGSAANWVTJ-UHFFFAOYSA-N
MW266.39 g/mol
LogP0.66
Rot. Bonds8

About N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine

N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine (PubChem CID 106617479) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
PubChem CID106617479
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCOCCN(CCc1nccn1C)CC1CCCN1
InChIInChI=1S/C14H26N4O/c1-17-9-7-16-14(17)5-8-18(10-11-19-2)12-13-4-3-6-15-13/h7,9,13,15H,3-6,8,10-12H2,1-2H3
InChIKeyCGPMJGSAANWVTJ-UHFFFAOYSA-N
XLogP0.66
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The IUPAC name of N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine (CID 106617479) is N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine is COCCN(CCc1nccn1C)CC1CCCN1.
What is the InChIKey of N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The InChIKey is CGPMJGSAANWVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-17-9-7-16-14(17)5-8-18(10-11-19-2)12-13-4-3-6-15-13/h7,9,13,15H,3-6,8,10-12H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine has a molecular weight of 266.39 g/mol, XLogP of 0.66, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106617479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).