N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide

C13H26N4O3 — CID 63102245

IUPACN-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide
SMILESCCNC(=O)NC(=O)CN1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C13H26N4O3/c1-4-14-12(19)15-11(18)9-16-5-7-17(8-6-16)10-13(2,3)20/h20H,4-10H2,1-3H3,(H2,14,15,18,19)
InChIKeyGNOYWTXBBVDYNO-UHFFFAOYSA-N
MW286.38 g/mol
LogP-0.78
Rot. Bonds5

About N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide

N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide (PubChem CID 63102245) has the molecular formula C13H26N4O3 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide
PubChem CID63102245
Molecular FormulaC13H26N4O3
Molecular Weight286.38 g/mol
Exact Mass286.20
IUPAC NameN-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide
SMILESCCNC(=O)NC(=O)CN1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C13H26N4O3/c1-4-14-12(19)15-11(18)9-16-5-7-17(8-6-16)10-13(2,3)20/h20H,4-10H2,1-3H3,(H2,14,15,18,19)
InChIKeyGNOYWTXBBVDYNO-UHFFFAOYSA-N
XLogP-0.78
TPSA84.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]-N-(2-methylbutan-2-yl)acetamide
CID 63101713
2-[4-[2-(ethylcarbamoylamino)-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 30967520
3-[1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]propanoic acid
CID 62217877
tert-butyl N-[[1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbamate
CID 51102081
2-(3-aminoazetidin-1-yl)-N-(ethylcarbamoyl)acetamide
CID 65249628
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-(ethylcarbamoyl)acetamide
CID 25376066
ethyl 1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxylate
CID 27152328
N-(ethylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 27150301
N-(ethylcarbamoyl)-2-[(3S)-3-methylpiperazin-1-yl]acetamide
CID 104976988
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(ethylcarbamoyl)acetamide
CID 8529745
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-N-(ethylcarbamoyl)acetamide
CID 124744214
N-(ethylcarbamoyl)-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898104

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide (CID 63102245) is N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide is CCNC(=O)NC(=O)CN1CCN(CC(C)(C)O)CC1.
What is the InChIKey of N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide?
The InChIKey is GNOYWTXBBVDYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O3/c1-4-14-12(19)15-11(18)9-16-5-7-17(8-6-16)10-13(2,3)20/h20H,4-10H2,1-3H3,(H2,14,15,18,19).
What are the key properties of N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide?
N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide has a molecular weight of 286.38 g/mol, XLogP of -0.78, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 63102245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).