N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide

C11H17F2NO — CID 156872223

IUPACN-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide
SMILESCCNC(=O)C1CCC2(CC1)CC2(F)F
InChIInChI=1S/C11H17F2NO/c1-2-14-9(15)8-3-5-10(6-4-8)7-11(10,12)13/h8H,2-7H2,1H3,(H,14,15)
InChIKeyOVEZMUNDYKAFMO-UHFFFAOYSA-N
MW217.26 g/mol
LogP2.34
Rot. Bonds2

About N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide

N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide (PubChem CID 156872223) has the molecular formula C11H17F2NO and a molecular weight of 217.26 g/mol. Its IUPAC name is N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide
PubChem CID156872223
Molecular FormulaC11H17F2NO
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC NameN-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide
SMILESCCNC(=O)C1CCC2(CC1)CC2(F)F
InChIInChI=1S/C11H17F2NO/c1-2-14-9(15)8-3-5-10(6-4-8)7-11(10,12)13/h8H,2-7H2,1H3,(H,14,15)
InChIKeyOVEZMUNDYKAFMO-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-difluorospiro[2.5]octane-6-carboxylic acid;N-[(2,2-difluorospiro[2.5]octan-6-yl)methyl]ethanamine;N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide
CID 165074529
1-(2,2-difluorospiro[2.5]octan-6-yl)propan-1-one
CID 130457436
ethane;N-ethyl-4-hydroxycyclohexane-1-carboxamide
CID 164564557
N-ethylspiro[3.3]heptane-2-carboxamide
CID 164555902
N-ethyl-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 51077622
N-ethyl-4-(2,3,3-trimethylbutan-2-yl)cyclohexane-1-carboxamide
CID 139316795
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide
CID 91660383
N-ethyl-1-fluorocyclopropane-1-carboxamide;molecular hydrogen
CID 176683431
(3S)-5-(ethylcarbamoyl)cyclohexane-1,3-dicarboxylic acid
CID 70985200
N-[2-(2-chloroethyl)pentyl]-4,4-difluorocyclohexane-1-carboxamide
CID 106117502
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide;hydrochloride
CID 91660382
1-[4-(cyclopropanecarbonylamino)phenyl]-N-ethylpiperidine-4-carboxamide
CID 110668128

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide?
The IUPAC name of N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide (CID 156872223) is N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide.
What is the SMILES notation for N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide?
The canonical SMILES for N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide is CCNC(=O)C1CCC2(CC1)CC2(F)F.
What is the InChIKey of N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide?
The InChIKey is OVEZMUNDYKAFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F2NO/c1-2-14-9(15)8-3-5-10(6-4-8)7-11(10,12)13/h8H,2-7H2,1H3,(H,14,15).
What are the key properties of N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide?
N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide has a molecular weight of 217.26 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-difluorospiro[2.5]octane-6-carboxamide is sourced from PubChem (CID 156872223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).