N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide

C10H17F2NO2 — CID 107482974

IUPACN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C10H17F2NO2/c1-10(2)5-7(10)9(15)13(3-4-14)6-8(11)12/h7-8,14H,3-6H2,1-2H3
InChIKeyHONYBTQAVGKDNL-UHFFFAOYSA-N
MW221.25 g/mol
LogP1.12
Rot. Bonds5

About N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide (PubChem CID 107482974) has the molecular formula C10H17F2NO2 and a molecular weight of 221.25 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide
PubChem CID107482974
Molecular FormulaC10H17F2NO2
Molecular Weight221.25 g/mol
Exact Mass221.12
IUPAC NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C10H17F2NO2/c1-10(2)5-7(10)9(15)13(3-4-14)6-8(11)12/h7-8,14H,3-6H2,1-2H3
InChIKeyHONYBTQAVGKDNL-UHFFFAOYSA-N
XLogP1.12
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.25
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11183471
N-(2-hydroxyethyl)-N,2,2,3,3-pentamethylcyclopropane-1-carboxamide
CID 11206424
1-fluoro-N-(2-hydroxyethyl)-N,2-dimethylcyclopropane-1-carboxamide
CID 156303121
(4-hydroxypiperidin-1-yl)-[(1S,2S)-1-methyl-2-(trifluoromethyl)cyclopropyl]methanone
CID 172557659
(4-hydroxypiperidin-1-yl)-[(1R,2R)-1-methyl-2-(trifluoromethyl)cyclopropyl]methanone
CID 172557679
2-[(2,2,3,3-Tetramethylcyclopropanecarbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258138
N,1-dimethyl-N-(3,3,3-trifluoro-2-hydroxypropyl)cyclobutane-1-carboxamide
CID 86790741
N,1-dimethyl-N-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]cyclobutane-1-carboxamide
CID 97880237
N,1-dimethyl-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]cyclobutane-1-carboxamide
CID 97880238
N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)pentanamide
CID 103526181
2,2,3,3-tetramethyl-N-(3,3,3-trifluoro-2-hydroxypropyl)cyclopropane-1-carboxamide
CID 103726470
N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 103770160

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide (CID 107482974) is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide is CC1(C)CC1C(=O)N(CCO)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is HONYBTQAVGKDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F2NO2/c1-10(2)5-7(10)9(15)13(3-4-14)6-8(11)12/h7-8,14H,3-6H2,1-2H3.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide?
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 221.25 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 107482974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).