N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C11H19F2NO2 — CID 103770160

IUPACN-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCC(O)C(F)F)C1(C)C
InChIInChI=1S/C11H19F2NO2/c1-10(2)7(11(10,3)4)9(16)14-5-6(15)8(12)13/h6-8,15H,5H2,1-4H3,(H,14,16)
InChIKeyOILRZFUIOTVZHY-UHFFFAOYSA-N
MW235.27 g/mol
LogP1.41
Rot. Bonds4

About N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 103770160) has the molecular formula C11H19F2NO2 and a molecular weight of 235.27 g/mol. Its IUPAC name is N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID103770160
Molecular FormulaC11H19F2NO2
Molecular Weight235.27 g/mol
Exact Mass235.14
IUPAC NameN-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCC(O)C(F)F)C1(C)C
InChIInChI=1S/C11H19F2NO2/c1-10(2)7(11(10,3)4)9(16)14-5-6(15)8(12)13/h6-8,15H,5H2,1-4H3,(H,14,16)
InChIKeyOILRZFUIOTVZHY-UHFFFAOYSA-N
XLogP1.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 103770160) is N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)NCC(O)C(F)F)C1(C)C.
What is the InChIKey of N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is OILRZFUIOTVZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2NO2/c1-10(2)7(11(10,3)4)9(16)14-5-6(15)8(12)13/h6-8,15H,5H2,1-4H3,(H,14,16).
What are the key properties of N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 235.27 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 103770160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).