N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide

C13H20N4O2 — CID 62995583

IUPACN-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide
SMILESCOc1cc(CNC(=O)CN2CCNCC2)ccn1
InChIInChI=1S/C13H20N4O2/c1-19-13-8-11(2-3-15-13)9-16-12(18)10-17-6-4-14-5-7-17/h2-3,8,14H,4-7,9-10H2,1H3,(H,16,18)
InChIKeyJGZGCRUNPRVEFT-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.39
Rot. Bonds5

About N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide

N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide (PubChem CID 62995583) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide
PubChem CID62995583
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide
SMILESCOc1cc(CNC(=O)CN2CCNCC2)ccn1
InChIInChI=1S/C13H20N4O2/c1-19-13-8-11(2-3-15-13)9-16-12(18)10-17-6-4-14-5-7-17/h2-3,8,14H,4-7,9-10H2,1H3,(H,16,18)
InChIKeyJGZGCRUNPRVEFT-UHFFFAOYSA-N
XLogP-0.39
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methoxy-4-pyridinyl)methyl]-2-piperidin-4-yloxyacetamide
CID 63875211
2-(3-amino-1,2,4-triazol-1-yl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 62989300
2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide
CID 167927821
N-[(2-methoxy-4-pyridinyl)methyl]-2-(propylamino)acetamide
CID 62995403
N-[(2-methoxy-4-pyridinyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 62997538
2-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 18167308
2-(4-methoxyphenoxy)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 47019682
5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]pentanamide
CID 62994356
N-[(2-methoxy-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 34677256
N-[(2-methoxy-4-pyridinyl)methyl]-3-methylpyrrolidine-2-carboxamide
CID 102779392
N-[(2-methoxy-4-pyridinyl)methyl]cyclopropanecarboxamide
CID 60715595
N-(4-fluorophenyl)-2-[4-[(2-methoxy-4-pyridinyl)methyl]piperazin-1-yl]acetamide
CID 166605769

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide?
The IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide (CID 62995583) is N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide?
The canonical SMILES for N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide is COc1cc(CNC(=O)CN2CCNCC2)ccn1.
What is the InChIKey of N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide?
The InChIKey is JGZGCRUNPRVEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-19-13-8-11(2-3-15-13)9-16-12(18)10-17-6-4-14-5-7-17/h2-3,8,14H,4-7,9-10H2,1H3,(H,16,18).
What are the key properties of N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide?
N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide has a molecular weight of 264.33 g/mol, XLogP of -0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide is sourced from PubChem (CID 62995583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).