N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide

C10H7F12NO — CID 3089677

IUPACN-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide
SMILESO=C(NC1CC1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C10H7F12NO/c11-4(12)6(13,14)8(17,18)10(21,22)9(19,20)7(15,16)5(24)23-3-1-2-3/h3-4H,1-2H2,(H,23,24)
InChIKeyHRVVWMWIXQAFRJ-UHFFFAOYSA-N
MW385.15 g/mol
LogP3.71
Rot. Bonds7

About N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide

N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide (PubChem CID 3089677) has the molecular formula C10H7F12NO and a molecular weight of 385.15 g/mol. Its IUPAC name is N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide.

Molecular Properties

Compound NameN-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide
PubChem CID3089677
Molecular FormulaC10H7F12NO
Molecular Weight385.15 g/mol
Exact Mass385.03
IUPAC NameN-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide
SMILESO=C(NC1CC1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C10H7F12NO/c11-4(12)6(13,14)8(17,18)10(21,22)9(19,20)7(15,16)5(24)23-3-1-2-3/h3-4H,1-2H2,(H,23,24)
InChIKeyHRVVWMWIXQAFRJ-UHFFFAOYSA-N
XLogP3.71
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.15
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide?
The IUPAC name of N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide (CID 3089677) is N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide.
What is the SMILES notation for N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide?
The canonical SMILES for N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide is O=C(NC1CC1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide?
The InChIKey is HRVVWMWIXQAFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F12NO/c11-4(12)6(13,14)8(17,18)10(21,22)9(19,20)7(15,16)5(24)23-3-1-2-3/h3-4H,1-2H2,(H,23,24).
What are the key properties of N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide?
N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide has a molecular weight of 385.15 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanamide is sourced from PubChem (CID 3089677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).