2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide

C9H18F2N2O — CID 103107862

IUPAC2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(C)C(F)F
InChIInChI=1S/C9H18F2N2O/c1-5-13(4)9(14)7(3)12-6(2)8(10)11/h6-8,12H,5H2,1-4H3
InChIKeyQSDYXUJJFPGELU-UHFFFAOYSA-N
MW208.25 g/mol
LogP1.10
Rot. Bonds5

About 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide

2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide (PubChem CID 103107862) has the molecular formula C9H18F2N2O and a molecular weight of 208.25 g/mol. Its IUPAC name is 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide
PubChem CID103107862
Molecular FormulaC9H18F2N2O
Molecular Weight208.25 g/mol
Exact Mass208.14
IUPAC Name2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(C)C(F)F
InChIInChI=1S/C9H18F2N2O/c1-5-13(4)9(14)7(3)12-6(2)8(10)11/h6-8,12H,5H2,1-4H3
InChIKeyQSDYXUJJFPGELU-UHFFFAOYSA-N
XLogP1.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.25
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-methyl-2-(propan-2-ylamino)propanamide
CID 103107904
methyl 3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-2-methylbutanoate
CID 103108458
2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylacetamide
CID 107644951
methyl 3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]butanoate
CID 103108828
2-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-N-pentan-2-ylpropanamide
CID 103108377
2-(cyanomethylamino)-N-ethyl-N-methylpropanamide
CID 103108493
N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide
CID 103108877
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-methylpropanamide
CID 103108801
2-(butylamino)-N-ethyl-N-methylpropanamide
CID 103107906
methyl 2-(1,1-difluoropropan-2-ylamino)propanoate
CID 102869349
N-ethyl-2-[1-(3-fluorophenyl)ethylamino]-N-methylpropanamide
CID 103106950
4-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103499411

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide (CID 103107862) is 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)NC(C)C(F)F.
What is the InChIKey of 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide?
The InChIKey is QSDYXUJJFPGELU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2O/c1-5-13(4)9(14)7(3)12-6(2)8(10)11/h6-8,12H,5H2,1-4H3.
What are the key properties of 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide?
2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide has a molecular weight of 208.25 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103107862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).