N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide

C13H27N3O2 — CID 95350415

IUPACN-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC[C@@H]1CN(CCNC(C)=O)CCN1CCOC
InChIInChI=1S/C13H27N3O2/c1-4-13-11-15(6-5-14-12(2)17)7-8-16(13)9-10-18-3/h13H,4-11H2,1-3H3,(H,14,17)/t13-/m1/s1
InChIKeyCNNMZBFUANQMSC-CYBMUJFWSA-N
MW257.38 g/mol
LogP0.17
Rot. Bonds7

About N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide

N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide (PubChem CID 95350415) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide
PubChem CID95350415
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC NameN-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC[C@@H]1CN(CCNC(C)=O)CCN1CCOC
InChIInChI=1S/C13H27N3O2/c1-4-13-11-15(6-5-14-12(2)17)7-8-16(13)9-10-18-3/h13H,4-11H2,1-3H3,(H,14,17)/t13-/m1/s1
InChIKeyCNNMZBFUANQMSC-CYBMUJFWSA-N
XLogP0.17
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-4-butyl-2-ethyl-1-(2-methoxyethyl)piperazine
CID 100839425
1-[4-[[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]methyl]piperidin-1-yl]ethanone
CID 95343221
2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]acetonitrile
CID 95333035
(2R)-2-ethyl-1-(2-methoxyethyl)-4-prop-2-enylpiperazine
CID 95333013
2-[3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]propanoic acid
CID 119135356
1-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]acetyl]imidazolidin-2-one
CID 95344088
N-(1-cyanocyclopentyl)-2-[(3S)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]acetamide
CID 95336625
1-[3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]-4-(methylamino)butan-1-one;dihydrochloride
CID 119880349
(2R)-2-ethyl-1-(2-methoxyethyl)-4-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]piperazine
CID 124840342
N-(5-chloro-2-pyridinyl)-2-[(3S)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]acetamide
CID 95333683
N-[2-(2-ethyl-3-methylimidazolidin-1-yl)ethyl]acetamide
CID 20581832
(2R)-2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
CID 124778877

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide (CID 95350415) is N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide is CC[C@@H]1CN(CCNC(C)=O)CCN1CCOC.
What is the InChIKey of N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide?
The InChIKey is CNNMZBFUANQMSC-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-4-13-11-15(6-5-14-12(2)17)7-8-16(13)9-10-18-3/h13H,4-11H2,1-3H3,(H,14,17)/t13-/m1/s1.
What are the key properties of N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide?
N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide has a molecular weight of 257.38 g/mol, XLogP of 0.17, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide is sourced from PubChem (CID 95350415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).