N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide

C10H14F5NO — CID 114038274

IUPACN-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide
SMILESCCN(CC1CCC1)C(=O)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H14F5NO/c1-2-16(6-7-4-3-5-7)8(17)9(11,12)10(13,14)15/h7H,2-6H2,1H3
InChIKeyAQQHQXWDONKLSX-UHFFFAOYSA-N
MW259.22 g/mol
LogP2.83
Rot. Bonds4

About N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide

N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide (PubChem CID 114038274) has the molecular formula C10H14F5NO and a molecular weight of 259.22 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide
PubChem CID114038274
Molecular FormulaC10H14F5NO
Molecular Weight259.22 g/mol
Exact Mass259.10
IUPAC NameN-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide
SMILESCCN(CC1CCC1)C(=O)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H14F5NO/c1-2-16(6-7-4-3-5-7)8(17)9(11,12)10(13,14)15/h7H,2-6H2,1H3
InChIKeyAQQHQXWDONKLSX-UHFFFAOYSA-N
XLogP2.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.22
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(cyclobutylmethyl)-N-ethyl-2-methylpropanamide
CID 107398375
3-chloro-N-(cyclobutylmethyl)-N-ethyl-2,2-dimethylpropanamide
CID 107397616
2-[[cyclobutylmethyl(ethyl)carbamoyl]-(2,2,2-trifluoroethyl)amino]acetic acid
CID 107400173
3-[cyclopropylmethyl(ethyl)amino]-2,2-dimethyl-3-oxopropanoic acid
CID 82820640
3-[tert-butyl-[cyclobutylmethyl(ethyl)carbamoyl]amino]propanoic acid
CID 107400040
3-amino-N-(cyclobutylmethyl)-N-ethylpropanamide
CID 107397900
N-(cyclobutylmethyl)-N-ethylpyrrolidine-1-carboxamide
CID 107397947
1,1-bis(cyclopropylmethyl)-3,3-diethylurea
CID 115629557
1-(cyclobutylmethyl)-1-ethyl-3-methylthiourea
CID 107397920
N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide
CID 107397929
1-carbamothioyl-N-(cyclobutylmethyl)-N-ethylcyclopropane-1-carboxamide
CID 107398769
2-hydroxyethyl N-(cyclobutylmethyl)-N-ethylcarbamate
CID 107402491

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide (CID 114038274) is N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide is CCN(CC1CCC1)C(=O)C(F)(F)C(F)(F)F.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide?
The InChIKey is AQQHQXWDONKLSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F5NO/c1-2-16(6-7-4-3-5-7)8(17)9(11,12)10(13,14)15/h7H,2-6H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide?
N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide has a molecular weight of 259.22 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide is sourced from PubChem (CID 114038274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).