2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide

C14H27N3O2 — CID 115178337

IUPAC2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
SMILESCN1CCNC(CC(=O)NCCC2CCOCC2)C1
InChIInChI=1S/C14H27N3O2/c1-17-7-6-15-13(11-17)10-14(18)16-5-2-12-3-8-19-9-4-12/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyYIAZJHVJXAZEAW-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.21
Rot. Bonds5

About 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide

2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide (PubChem CID 115178337) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
PubChem CID115178337
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
SMILESCN1CCNC(CC(=O)NCCC2CCOCC2)C1
InChIInChI=1S/C14H27N3O2/c1-17-7-6-15-13(11-17)10-14(18)16-5-2-12-3-8-19-9-4-12/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyYIAZJHVJXAZEAW-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide
CID 115178336
N-(3,3-dimethylbutyl)-2-(4-methylpiperazin-2-yl)acetamide
CID 115178327
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 113267487
2-(1-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115178445
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941640
2-(4-methylpiperazin-2-yl)-N-(1-methylpiperidin-4-yl)acetamide
CID 115178258
tert-butyl N-[2-(4-methylpiperazin-2-yl)ethyl]carbamate
CID 82386141
2-(methylamino)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115152043
N-(2-cyclohexylethyl)-2-piperidin-2-ylacetamide
CID 54932758
2-(2-methoxyethylamino)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 119724840
N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119725744
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119865927

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide?
The IUPAC name of 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide (CID 115178337) is 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide is CN1CCNC(CC(=O)NCCC2CCOCC2)C1.
What is the InChIKey of 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide?
The InChIKey is YIAZJHVJXAZEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-17-7-6-15-13(11-17)10-14(18)16-5-2-12-3-8-19-9-4-12/h12-13,15H,2-11H2,1H3,(H,16,18).
What are the key properties of 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide?
2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide has a molecular weight of 269.39 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide is sourced from PubChem (CID 115178337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).