N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide

C12H20F2N2O2 — CID 107485411

IUPACN-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
SMILESCN(C(=O)CN(CCO)CC(F)F)C1=CCCC1
InChIInChI=1S/C12H20F2N2O2/c1-15(10-4-2-3-5-10)12(18)9-16(6-7-17)8-11(13)14/h4,11,17H,2-3,5-9H2,1H3
InChIKeyDBSWJIQREFUYGB-UHFFFAOYSA-N
MW262.30 g/mol
LogP1.07
Rot. Bonds7

About N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide

N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide (PubChem CID 107485411) has the molecular formula C12H20F2N2O2 and a molecular weight of 262.30 g/mol. Its IUPAC name is N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide.

Molecular Properties

Compound NameN-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
PubChem CID107485411
Molecular FormulaC12H20F2N2O2
Molecular Weight262.30 g/mol
Exact Mass262.15
IUPAC NameN-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
SMILESCN(C(=O)CN(CCO)CC(F)F)C1=CCCC1
InChIInChI=1S/C12H20F2N2O2/c1-15(10-4-2-3-5-10)12(18)9-16(6-7-17)8-11(13)14/h4,11,17H,2-3,5-9H2,1H3
InChIKeyDBSWJIQREFUYGB-UHFFFAOYSA-N
XLogP1.07
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide 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-[Cyclopenten-1-yl(methyl)amino]-2-oxoethyl]-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258853
2-[[2-[Cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79262231
N-(cyclopenten-1-yl)-N-ethyl-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 103864828
N-(cyclopenten-1-yl)-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylacetamide
CID 103865000
N-(cyclohexen-1-yl)-N-ethyl-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 103865019
N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-ethylacetamide
CID 107485088
N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
CID 107485499
N-(cyclohexen-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-ethylacetamide
CID 107485682
2-[[2-[Cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-methylamino]acetic acid
CID 43442341
2-[[2-[Cyclopenten-1-yl(methyl)amino]-2-oxoethyl]-methylamino]acetic acid
CID 43442661
2-[[2-[Cyclopenten-1-yl(methyl)amino]-2-oxoethyl]-ethylamino]acetic acid
CID 54900285
2-[[2-[Cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-ethylamino]acetic acid
CID 54900337

Frequently Asked Questions

What is the IUPAC name of N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The IUPAC name of N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide (CID 107485411) is N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide.
What is the SMILES notation for N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The canonical SMILES for N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide is CN(C(=O)CN(CCO)CC(F)F)C1=CCCC1.
What is the InChIKey of N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The InChIKey is DBSWJIQREFUYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F2N2O2/c1-15(10-4-2-3-5-10)12(18)9-16(6-7-17)8-11(13)14/h4,11,17H,2-3,5-9H2,1H3.
What are the key properties of N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide has a molecular weight of 262.30 g/mol, XLogP of 1.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenten-1-yl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide is sourced from PubChem (CID 107485411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).