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

C11H19F2NO2 — CID 104858100

IUPACN-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCC(F)(F)CO)C1(C)C
InChIInChI=1S/C11H19F2NO2/c1-9(2)7(10(9,3)4)8(16)14-5-11(12,13)6-15/h7,15H,5-6H2,1-4H3,(H,14,16)
InChIKeyMMOYZFPZVLBNSW-UHFFFAOYSA-N
MW235.27 g/mol
LogP1.41
Rot. Bonds4

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

N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 104858100) has the molecular formula C11H19F2NO2 and a molecular weight of 235.27 g/mol. Its IUPAC name is N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID104858100
Molecular FormulaC11H19F2NO2
Molecular Weight235.27 g/mol
Exact Mass235.14
IUPAC NameN-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCC(F)(F)CO)C1(C)C
InChIInChI=1S/C11H19F2NO2/c1-9(2)7(10(9,3)4)8(16)14-5-11(12,13)6-15/h7,15H,5-6H2,1-4H3,(H,14,16)
InChIKeyMMOYZFPZVLBNSW-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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Related Compounds

N-(2-hydroxyethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11183050
N-(1-hydroxypropan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11217870
N-(1-hydroxybutan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11218142
N-(3-hydroxy-4,4-dimethylpentyl)cyclopropanecarboxamide
CID 71787566
N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropanecarboxamide
CID 56743494
2,2-difluoro-3,3-dimethyl-N-propylcyclopropane-1-carboxamide;ethane
CID 164555511
ethane;N-ethyl-2,2-difluoro-3,3-dimethylcyclopropane-1-carboxamide
CID 164556084
4,4-difluoro-N-(3-hydroxy-2,2-dimethylpropyl)cyclohexane-1-carboxamide
CID 81932832
4,4-difluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]cyclohexane-1-carboxamide
CID 81932870
N-(2,2-difluoro-3-hydroxypropyl)-3-methylpentanamide
CID 103526983
3,4,4-trimethyl-N-(3,3,3-trifluoro-2-hydroxypropyl)pentanamide
CID 103726295
2,2,3,3-tetramethyl-N-(3,3,3-trifluoro-2-hydroxypropyl)cyclopropane-1-carboxamide
CID 103726470

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 104858100) is N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)NCC(F)(F)CO)C1(C)C.
What is the InChIKey of N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is MMOYZFPZVLBNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2NO2/c1-9(2)7(10(9,3)4)8(16)14-5-11(12,13)6-15/h7,15H,5-6H2,1-4H3,(H,14,16).
What are the key properties of N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(2,2-difluoro-3-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-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 104858100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).