N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide

C16H26N4O — CID 154706604

IUPACN,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide
SMILESCCN(CC)C(=O)CC1CNCCN1Cc1ccccn1
InChIInChI=1S/C16H26N4O/c1-3-19(4-2)16(21)11-15-12-17-9-10-20(15)13-14-7-5-6-8-18-14/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyUXAORMBIWXXILO-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.11
Rot. Bonds6

About N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide

N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide (PubChem CID 154706604) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide
PubChem CID154706604
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide
SMILESCCN(CC)C(=O)CC1CNCCN1Cc1ccccn1
InChIInChI=1S/C16H26N4O/c1-3-19(4-2)16(21)11-15-12-17-9-10-20(15)13-14-7-5-6-8-18-14/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyUXAORMBIWXXILO-UHFFFAOYSA-N
XLogP1.11
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-methyl-1-(pyridin-2-ylmethyl)piperazine
CID 67972243
N-(cyclopropylmethyl)-2-[(2R)-3-oxo-1-(pyridin-2-ylmethyl)piperazin-2-yl]-N-propylacetamide
CID 95714500
2-[(2-ethylazetidin-1-yl)methyl]pyridine
CID 130678024
2-ethyl-1-pyridin-2-ylpiperazine
CID 63600435
2-(2-chlorophenyl)-1-(pyridin-2-ylmethyl)piperazine
CID 120768964
ethyl 2-[1-(pyridin-4-ylmethyl)piperazin-2-yl]acetate
CID 134465394
2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 115178439
2-[azepan-4-yl(pyridin-2-ylmethyl)amino]-N,N-diethylacetamide
CID 120869661
N,N-diethyl-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120869682
N,N-diethyl-2-[(4S)-1'-(pyridin-2-ylmethyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl]acetamide
CID 97376595
N,N-diethyl-2-[(4R)-1'-(pyridin-2-ylmethyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl]acetamide
CID 97376596
N-ethyl-N-piperidin-3-yl-2-pyridin-2-ylacetamide
CID 55247016

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide?
The IUPAC name of N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide (CID 154706604) is N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide.
What is the SMILES notation for N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide?
The canonical SMILES for N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide is CCN(CC)C(=O)CC1CNCCN1Cc1ccccn1.
What is the InChIKey of N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide?
The InChIKey is UXAORMBIWXXILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-19(4-2)16(21)11-15-12-17-9-10-20(15)13-14-7-5-6-8-18-14/h5-8,15,17H,3-4,9-13H2,1-2H3.
What are the key properties of N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide?
N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 1.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[1-(pyridin-2-ylmethyl)piperazin-2-yl]acetamide is sourced from PubChem (CID 154706604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).