N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide

C11H13F10NO — CID 21250096

IUPACN,N-bis(4,4,5,5,5-pentafluoropentyl)formamide
SMILESO=CN(CCCC(F)(F)C(F)(F)F)CCCC(F)(F)C(F)(F)F
InChIInChI=1S/C11H13F10NO/c12-8(13,10(16,17)18)3-1-5-22(7-23)6-2-4-9(14,15)11(19,20)21/h7H,1-6H2
InChIKeyMVEPGYSBVBZJHI-UHFFFAOYSA-N
MW365.21 g/mol
LogP4.40
Rot. Bonds9

About N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide

N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide (PubChem CID 21250096) has the molecular formula C11H13F10NO and a molecular weight of 365.21 g/mol. Its IUPAC name is N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide.

Molecular Properties

Compound NameN,N-bis(4,4,5,5,5-pentafluoropentyl)formamide
PubChem CID21250096
Molecular FormulaC11H13F10NO
Molecular Weight365.21 g/mol
Exact Mass365.08
IUPAC NameN,N-bis(4,4,5,5,5-pentafluoropentyl)formamide
SMILESO=CN(CCCC(F)(F)C(F)(F)F)CCCC(F)(F)C(F)(F)F
InChIInChI=1S/C11H13F10NO/c12-8(13,10(16,17)18)3-1-5-22(7-23)6-2-4-9(14,15)11(19,20)21/h7H,1-6H2
InChIKeyMVEPGYSBVBZJHI-UHFFFAOYSA-N
XLogP4.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.21
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis(2,2,3,3,4,4,4-heptafluorobutyl)formamide
CID 21250086
N,N-bis(2,3-difluoropropyl)formamide
CID 21311164
N-methyl-N-(4,4,5,5,5-pentafluoropentyl)formamide
CID 53910297
4,4-Difluoropiperidin-1-ylmethanone
CID 57455263
3,3-Difluoropiperidine-1-carbaldehyde
CID 87513186
N-cyclohexyl-N-(2,2,2-trifluoroethyl)formamide
CID 87617531
N-butyl-N-(2,2,2-trifluoroethyl)formamide;ethane
CID 166529351
3,3,4,4,5,5-Hexafluoropiperidine-1-carbaldehyde
CID 174048692
N-(3,3,4,4,5,5,5-heptafluoropentyl)-N-methylformamide
CID 174058660
N-cyclopentyl-N-(2,2,2-trifluoroethyl)formamide
CID 174736493
N-cyclopentyl-N-(2,2-difluoroethyl)formamide
CID 174909287
N-methyl-N-(4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononyl)formamide
CID 11697419

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide?
The IUPAC name of N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide (CID 21250096) is N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide.
What is the SMILES notation for N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide?
The canonical SMILES for N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide is O=CN(CCCC(F)(F)C(F)(F)F)CCCC(F)(F)C(F)(F)F.
What is the InChIKey of N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide?
The InChIKey is MVEPGYSBVBZJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F10NO/c12-8(13,10(16,17)18)3-1-5-22(7-23)6-2-4-9(14,15)11(19,20)21/h7H,1-6H2.
What are the key properties of N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide?
N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide has a molecular weight of 365.21 g/mol, XLogP of 4.40, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4,4,5,5,5-pentafluoropentyl)formamide is sourced from PubChem (CID 21250096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).