N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide

C10H10F9NO — CID 59464916

IUPACN-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide
SMILESC=CC(=O)N(CC)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H10F9NO/c1-3-6(21)20(4-2)5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,1,4-5H2,2H3
InChIKeyZNZVIQZNJPQJNX-UHFFFAOYSA-N
MW331.18 g/mol
LogP3.49
Rot. Bonds6

About N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide

N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide (PubChem CID 59464916) has the molecular formula C10H10F9NO and a molecular weight of 331.18 g/mol. Its IUPAC name is N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide.

Molecular Properties

Compound NameN-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide
PubChem CID59464916
Molecular FormulaC10H10F9NO
Molecular Weight331.18 g/mol
Exact Mass331.06
IUPAC NameN-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide
SMILESC=CC(=O)N(CC)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H10F9NO/c1-3-6(21)20(4-2)5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,1,4-5H2,2H3
InChIKeyZNZVIQZNJPQJNX-UHFFFAOYSA-N
XLogP3.49
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.18
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

n,n-Dihexylacrylamide
CID 10857576
N,N-Bis(2,2-difluoroethyl)acrylamide
CID 19792307
N-(3,3-difluoroprop-2-enyl)-N-methylpentanamide
CID 20644847
N-(3,3,4,4,5,5,6,6,6-nonafluorohexan-2-yl)-N-propylprop-2-enamide
CID 21020707
N-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-N-methylprop-2-enamide
CID 21020711
N-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-N-propylprop-2-enamide
CID 21020712
N,2-dimethyl-N-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)prop-2-enamide
CID 21020714
N-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-N-methylprop-2-enamide
CID 21020721
N-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-N-propylprop-2-enamide
CID 21020722
N-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)-N-methylprop-2-enamide
CID 21020727
N-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)-N-propylprop-2-enamide
CID 21020728
N-(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyl)-N-methylprop-2-enamide
CID 21020733

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide?
The IUPAC name of N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide (CID 59464916) is N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide.
What is the SMILES notation for N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide?
The canonical SMILES for N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide is C=CC(=O)N(CC)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide?
The InChIKey is ZNZVIQZNJPQJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F9NO/c1-3-6(21)20(4-2)5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,1,4-5H2,2H3.
What are the key properties of N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide?
N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide has a molecular weight of 331.18 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)prop-2-enamide is sourced from PubChem (CID 59464916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).