3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide

C10H17F2NO — CID 164821522

IUPAC3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide
SMILESCC(C)[C@@H](C)NC(=O)C1CC(F)(F)C1
InChIInChI=1S/C10H17F2NO/c1-6(2)7(3)13-9(14)8-4-10(11,12)5-8/h6-8H,4-5H2,1-3H3,(H,13,14)/t7-/m1/s1
InChIKeyGVEPUFKSCASTBY-SSDOTTSWSA-N
MW205.25 g/mol
LogP2.19
Rot. Bonds3

About 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide

3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide (PubChem CID 164821522) has the molecular formula C10H17F2NO and a molecular weight of 205.25 g/mol. Its IUPAC name is 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide
PubChem CID164821522
Molecular FormulaC10H17F2NO
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide
SMILESCC(C)[C@@H](C)NC(=O)C1CC(F)(F)C1
InChIInChI=1S/C10H17F2NO/c1-6(2)7(3)13-9(14)8-4-10(11,12)5-8/h6-8H,4-5H2,1-3H3,(H,13,14)/t7-/m1/s1
InChIKeyGVEPUFKSCASTBY-SSDOTTSWSA-N
XLogP2.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(3,3-difluorocyclobutanecarbonyl)amino]propanoic acid
CID 119348545
3,3-difluoro-N-[(2R)-1-hydroxypropan-2-yl]cyclobutane-1-carboxamide
CID 130834234
N-(3-methylbutan-2-yl)pyrrolidine-3-carboxamide
CID 63005391
1-(3,3-difluorocyclobutyl)-2-methylpropan-1-one
CID 58812212
N-(3-methylbutan-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 78981655
(2R)-N-(3-methylbutan-2-yl)azetidine-2-carboxamide;hydrochloride
CID 130636662
3,3-difluoro-N-propylcyclobutane-1-carboxamide
CID 130711162
N-[4-(cyclopropylmethylamino)-3,4-dioxobutan-2-yl]-3,3-difluorocyclobutane-1-carboxamide
CID 139335059
(3S)-N-(3-methylbutan-2-yl)piperidine-3-carboxamide
CID 81123470
2-methyl-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
CID 106738718
N-(2,4-dimethylpentan-3-yl)cyclopropanecarboxamide
CID 100609902
1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
CID 131955942

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide?
The IUPAC name of 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide (CID 164821522) is 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide.
What is the SMILES notation for 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide?
The canonical SMILES for 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide is CC(C)[C@@H](C)NC(=O)C1CC(F)(F)C1.
What is the InChIKey of 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide?
The InChIKey is GVEPUFKSCASTBY-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H17F2NO/c1-6(2)7(3)13-9(14)8-4-10(11,12)5-8/h6-8H,4-5H2,1-3H3,(H,13,14)/t7-/m1/s1.
What are the key properties of 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide?
3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide has a molecular weight of 205.25 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N-[(2R)-3-methylbutan-2-yl]cyclobutane-1-carboxamide is sourced from PubChem (CID 164821522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).