2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide

C14H22N4O — CID 115178439

IUPAC2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide
SMILESCN1CCNCC1CC(=O)NCCc1ccccn1
InChIInChI=1S/C14H22N4O/c1-18-9-8-15-11-13(18)10-14(19)17-7-5-12-4-2-3-6-16-12/h2-4,6,13,15H,5,7-11H2,1H3,(H,17,19)
InChIKeyQESRAHMKQNFOOH-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.03
Rot. Bonds5

About 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide

2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 115178439) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID115178439
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide
SMILESCN1CCNCC1CC(=O)NCCc1ccccn1
InChIInChI=1S/C14H22N4O/c1-18-9-8-15-11-13(18)10-14(19)17-7-5-12-4-2-3-6-16-12/h2-4,6,13,15H,5,7-11H2,1H3,(H,17,19)
InChIKeyQESRAHMKQNFOOH-UHFFFAOYSA-N
XLogP0.03
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 110851953
2-[(1-methylpiperidin-4-yl)amino]-N-(2-pyridin-2-ylethyl)acetamide
CID 143176576
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 79608018
2-pyridin-2-yl-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 63630243
2-(1-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115178445
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-pyridin-2-ylethanamine
CID 63898763
3,5-dimethyl-N-(2-pyridin-2-ylethyl)piperidine-1-carboxamide
CID 47128142
2-[1-[(4-tert-butylphenyl)methyl]-5-oxopyrrolidin-2-yl]-N-(2-pyridin-2-ylethyl)acetamide
CID 166541858
N-(piperazin-1-ylmethyl)-2-pyridin-2-ylethanamine
CID 115230160
2-[4-[(3,5-difluorophenyl)methyl]-3-oxopiperazin-2-yl]-N-(2-pyridin-2-ylethyl)acetamide;hydrochloride
CID 110283963
2-(2,5-dimethyl-1,3-thiazol-4-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 91082228
2-[(2S)-1-methylpiperidin-2-yl]-N-[2-(2H-triazol-4-yl)ethyl]acetamide
CID 126449965

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide (CID 115178439) is 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide is CN1CCNCC1CC(=O)NCCc1ccccn1.
What is the InChIKey of 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is QESRAHMKQNFOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-18-9-8-15-11-13(18)10-14(19)17-7-5-12-4-2-3-6-16-12/h2-4,6,13,15H,5,7-11H2,1H3,(H,17,19).
What are the key properties of 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide?
2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 262.36 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 115178439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).