N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide

C14H26N4O2 — CID 124685267

IUPACN-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide
SMILESCN1CCC[C@H](CN(C)C(=O)CN2CCNCC2=O)C1
InChIInChI=1S/C14H26N4O2/c1-16-6-3-4-12(9-16)10-17(2)14(20)11-18-7-5-15-8-13(18)19/h12,15H,3-11H2,1-2H3/t12-/m0/s1
InChIKeyJFZSQXCTMIPJLA-LBPRGKRZSA-N
MW282.39 g/mol
LogP-0.78
Rot. Bonds4

About N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide

N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide (PubChem CID 124685267) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide
PubChem CID124685267
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC NameN-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide
SMILESCN1CCC[C@H](CN(C)C(=O)CN2CCNCC2=O)C1
InChIInChI=1S/C14H26N4O2/c1-16-6-3-4-12(9-16)10-17(2)14(20)11-18-7-5-15-8-13(18)19/h12,15H,3-11H2,1-2H3/t12-/m0/s1
InChIKeyJFZSQXCTMIPJLA-LBPRGKRZSA-N
XLogP-0.78
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
CID 62310011
N,N-diethyl-2-(2-oxopiperazin-1-yl)acetamide
CID 62311999
N-methyl-N-[(1-methylpiperidin-3-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119855559
N,1-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]piperazine-2-carboxamide
CID 115177847
1-(cyclobutylmethyl)piperazin-2-one;hydrochloride
CID 67085388
1-methyl-1-[(1-methylpiperidin-3-yl)methyl]urea
CID 115168460
N-methyl-2-(methylamino)-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide
CID 63274011
N-(cyclopropylmethyl)-2-(1,4-diazepan-1-yl)-N-methylacetamide
CID 62839573
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-2-pyrrolidin-3-ylacetamide
CID 115160418
N-methyl-N-(oxan-3-ylmethyl)-2-piperazin-1-ylacetamide
CID 55227020
N-methyl-N-[(1-methylpiperidin-3-yl)methyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941363
N-methyl-N-[[(3R)-1-methylpiperidin-3-yl]methyl]-4-oxo-4-phenylbutanamide
CID 95208686

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide?
The IUPAC name of N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide (CID 124685267) is N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide.
What is the SMILES notation for N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide?
The canonical SMILES for N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide is CN1CCC[C@H](CN(C)C(=O)CN2CCNCC2=O)C1.
What is the InChIKey of N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide?
The InChIKey is JFZSQXCTMIPJLA-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-16-6-3-4-12(9-16)10-17(2)14(20)11-18-7-5-15-8-13(18)19/h12,15H,3-11H2,1-2H3/t12-/m0/s1.
What are the key properties of N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide?
N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide has a molecular weight of 282.39 g/mol, XLogP of -0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]-2-(2-oxopiperazin-1-yl)acetamide is sourced from PubChem (CID 124685267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).