N-(2,2-difluorocyclopentyl)butanamide

C9H15F2NO — CID 127009453

IUPACN-(2,2-difluorocyclopentyl)butanamide
SMILESCCCC(=O)NC1CCCC1(F)F
InChIInChI=1S/C9H15F2NO/c1-2-4-8(13)12-7-5-3-6-9(7,10)11/h7H,2-6H2,1H3,(H,12,13)
InChIKeyKGTFBLMTAKCHSK-UHFFFAOYSA-N
MW191.22 g/mol
LogP2.09
Rot. Bonds3

About N-(2,2-difluorocyclopentyl)butanamide

N-(2,2-difluorocyclopentyl)butanamide (PubChem CID 127009453) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is N-(2,2-difluorocyclopentyl)butanamide.

Molecular Properties

Compound NameN-(2,2-difluorocyclopentyl)butanamide
PubChem CID127009453
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC NameN-(2,2-difluorocyclopentyl)butanamide
SMILESCCCC(=O)NC1CCCC1(F)F
InChIInChI=1S/C9H15F2NO/c1-2-4-8(13)12-7-5-3-6-9(7,10)11/h7H,2-6H2,1H3,(H,12,13)
InChIKeyKGTFBLMTAKCHSK-UHFFFAOYSA-N
XLogP2.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-spiro[2.4]heptan-2-ylbutanamide
CID 130718596
N-(4,4-difluorocyclohexyl)butanamide
CID 131166223
N-(2,2-difluorocyclopentyl)-2-hydroxypropanamide
CID 131131943
N-(2,2-dimethylcyclopentyl)propanamide;ethane
CID 171523007
tert-butyl N-(2,2-difluorocyclopentyl)carbamate
CID 66792233
(2,2-difluorocyclohexyl)urea
CID 131126356
N-cyclooctylbutanamide
CID 4614062
2-(3-ethoxypropanoylamino)-1-methylcyclopentane-1-carboxylic acid
CID 82760761
4-amino-N-(2,2-dimethylcyclopentyl)-4-methylpentanamide
CID 79878624
3-chloro-N-(2,2-dimethylcyclohexyl)propanamide
CID 79870321
(2S)-2-amino-N-(2,2-difluorocyclohexyl)propanamide
CID 130942417
tert-butyl N-(2,2-difluorocyclohexyl)carbamate
CID 70317429

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluorocyclopentyl)butanamide?
The IUPAC name of N-(2,2-difluorocyclopentyl)butanamide (CID 127009453) is N-(2,2-difluorocyclopentyl)butanamide.
What is the SMILES notation for N-(2,2-difluorocyclopentyl)butanamide?
The canonical SMILES for N-(2,2-difluorocyclopentyl)butanamide is CCCC(=O)NC1CCCC1(F)F.
What is the InChIKey of N-(2,2-difluorocyclopentyl)butanamide?
The InChIKey is KGTFBLMTAKCHSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c1-2-4-8(13)12-7-5-3-6-9(7,10)11/h7H,2-6H2,1H3,(H,12,13).
What are the key properties of N-(2,2-difluorocyclopentyl)butanamide?
N-(2,2-difluorocyclopentyl)butanamide has a molecular weight of 191.22 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluorocyclopentyl)butanamide is sourced from PubChem (CID 127009453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).