N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide

C10H18F2N2O2 — CID 107484970

IUPACN-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
SMILESCN(C(=O)CN(CCO)CC(F)F)C1CC1
InChIInChI=1S/C10H18F2N2O2/c1-13(8-2-3-8)10(16)7-14(4-5-15)6-9(11)12/h8-9,15H,2-7H2,1H3
InChIKeyVCCJNCTYWQFFRK-UHFFFAOYSA-N
MW236.26 g/mol
LogP0.17
Rot. Bonds7

About N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide

N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide (PubChem CID 107484970) has the molecular formula C10H18F2N2O2 and a molecular weight of 236.26 g/mol. Its IUPAC name is N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
PubChem CID107484970
Molecular FormulaC10H18F2N2O2
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC NameN-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide
SMILESCN(C(=O)CN(CCO)CC(F)F)C1CC1
InChIInChI=1S/C10H18F2N2O2/c1-13(8-2-3-8)10(16)7-14(4-5-15)6-9(11)12/h8-9,15H,2-7H2,1H3
InChIKeyVCCJNCTYWQFFRK-UHFFFAOYSA-N
XLogP0.17
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
CID 107485234
3-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-(2-hydroxyethyl)amino]propanoic acid
CID 82327378
N-cyclohexyl-2-[2-hydroxyethyl(2-methoxyethyl)amino]-N-methylacetamide
CID 115613753
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 107485259
N-cyclohexyl-2-[cyclopropyl(2-hydroxyethyl)amino]-N-methylacetamide
CID 60774513
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 107485089
N-cyclopropyl-4-hydroxy-N-methylbutanamide
CID 79203211
2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
CID 102676811
2-[2,2-difluoroethyl(2-methylprop-2-enyl)amino]ethanol
CID 107485262
N-(1-cyano-1-cyclopropylethyl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
CID 107485470
N-(1,1-dioxothiolan-3-yl)-2-[2-hydroxyethyl(propyl)amino]-N-methylacetamide
CID 60691708
2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 61488998

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The IUPAC name of N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide (CID 107484970) is N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The canonical SMILES for N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide is CN(C(=O)CN(CCO)CC(F)F)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
The InChIKey is VCCJNCTYWQFFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O2/c1-13(8-2-3-8)10(16)7-14(4-5-15)6-9(11)12/h8-9,15H,2-7H2,1H3.
What are the key properties of N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide?
N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide has a molecular weight of 236.26 g/mol, XLogP of 0.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-methylacetamide is sourced from PubChem (CID 107484970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).