N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide

C7H14F2N2O — CID 103515493

IUPACN-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide
SMILESCN(C)CCN(C)C(=O)C(F)F
InChIInChI=1S/C7H14F2N2O/c1-10(2)4-5-11(3)7(12)6(8)9/h6H,4-5H2,1-3H3
InChIKeyFOZWMEQPIKMURT-UHFFFAOYSA-N
MW180.20 g/mol
LogP0.27
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide

N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide (PubChem CID 103515493) has the molecular formula C7H14F2N2O and a molecular weight of 180.20 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide
PubChem CID103515493
Molecular FormulaC7H14F2N2O
Molecular Weight180.20 g/mol
Exact Mass180.11
IUPAC NameN-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide
SMILESCN(C)CCN(C)C(=O)C(F)F
InChIInChI=1S/C7H14F2N2O/c1-10(2)4-5-11(3)7(12)6(8)9/h6H,4-5H2,1-3H3
InChIKeyFOZWMEQPIKMURT-UHFFFAOYSA-N
XLogP0.27
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.20
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-ethyl-N-methylbutanamide
CID 110481330
2,2-difluoro-N-methyl-N-[3-(methylamino)propyl]acetamide
CID 103514245
N-[2-(dimethylamino)ethyl]-2-methoxy-N-methylpropanamide
CID 115674309
N-[2-(dimethylamino)ethyl]-N-methylacetamide;ethane
CID 143604144
N-[2-(3,5-dimethylphenoxy)ethyl]-2,2-difluoro-N-methylacetamide
CID 113219438
N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide
CID 103514230
CID 174138442
CID 174138442
2,2-difluoro-N-methylacetohydrazide
CID 23268501
N-[3-(dimethylamino)propyl]-2,2-difluoroacetamide
CID 103600605
(3R)-5-(dimethylamino)-3-fluoropentan-2-one
CID 139565610
5-(dimethylamino)-3-fluoropentan-2-one
CID 139565635
N-[2-(dimethylamino)ethyl]-3,4,5-trifluoro-N-methylbenzamide
CID 63693984

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide (CID 103515493) is N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide is CN(C)CCN(C)C(=O)C(F)F.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide?
The InChIKey is FOZWMEQPIKMURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2N2O/c1-10(2)4-5-11(3)7(12)6(8)9/h6H,4-5H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide?
N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide has a molecular weight of 180.20 g/mol, XLogP of 0.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2,2-difluoro-N-methylacetamide is sourced from PubChem (CID 103515493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).