N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide

C11H16F2N4O2 — CID 107483168

IUPACN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide
SMILESCN(CC(=O)N(CCO)CC(F)F)c1ncccn1
InChIInChI=1S/C11H16F2N4O2/c1-16(11-14-3-2-4-15-11)8-10(19)17(5-6-18)7-9(12)13/h2-4,9,18H,5-8H2,1H3
InChIKeyZXDNWCAWJDRFCM-UHFFFAOYSA-N
MW274.27 g/mol
LogP-0.00
Rot. Bonds7

About N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide (PubChem CID 107483168) has the molecular formula C11H16F2N4O2 and a molecular weight of 274.27 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide
PubChem CID107483168
Molecular FormulaC11H16F2N4O2
Molecular Weight274.27 g/mol
Exact Mass274.12
IUPAC NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide
SMILESCN(CC(=O)N(CCO)CC(F)F)c1ncccn1
InChIInChI=1S/C11H16F2N4O2/c1-16(11-14-3-2-4-15-11)8-10(19)17(5-6-18)7-9(12)13/h2-4,9,18H,5-8H2,1H3
InChIKeyZXDNWCAWJDRFCM-UHFFFAOYSA-N
XLogP-0.00
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,2-Trifluoro-1-(4-pyrimidin-2-ylpiperazinyl)ethan-1-one
CID 753091
1-(2-Hydroxypropyl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]urea
CID 53504637
N,N-diethyl-2-[4-(2-pyrimidyl)piperazino]acetamide;oxalic acid
CID 651793
2-(4-(Pyrimidin-2-yl)piperazin-1-yl)ethan-1-ol
CID 14877867
2-[2-methoxyethyl(pyrimidin-2-yl)amino]-N,N-dimethylacetamide
CID 71981404
N-methyl-2-(pyrimidin-2-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 71996239
2-[2-methoxyethyl-(2-methylpyrimidin-4-yl)amino]-N,N-dimethylacetamide
CID 72109270
4-(5-Fluoropyrimidin-2-yl)-1-(2-methoxyethyl)piperazin-2-one
CID 75482849
1-(2,2-Difluoroethyl)-1-(2-hydroxyethyl)-3-(2-methylpyrimidin-4-yl)urea
CID 100650944
(3,3-Difluoroazetidin-1-yl)-pyrimidin-2-ylmethanone
CID 143638955
2,2,2-Trifluoro-1-(3-pyrimidin-2-yloxyazetidin-1-yl)ethanone
CID 161474158
1-(2-Hydroxyethyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-2-one
CID 175401742

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide (CID 107483168) is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide is CN(CC(=O)N(CCO)CC(F)F)c1ncccn1.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The InChIKey is ZXDNWCAWJDRFCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2N4O2/c1-16(11-14-3-2-4-15-11)8-10(19)17(5-6-18)7-9(12)13/h2-4,9,18H,5-8H2,1H3.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide?
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide has a molecular weight of 274.27 g/mol, XLogP of -0.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 107483168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).