2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide

C9H15F2NO2 — CID 103513974

IUPAC2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
SMILESO=C(NCC1(CO)CCCC1)C(F)F
InChIInChI=1S/C9H15F2NO2/c10-7(11)8(14)12-5-9(6-13)3-1-2-4-9/h7,13H,1-6H2,(H,12,14)
InChIKeyWUAHGNRNCNIWHH-UHFFFAOYSA-N
MW207.22 g/mol
LogP0.92
Rot. Bonds4

About 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide

2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide (PubChem CID 103513974) has the molecular formula C9H15F2NO2 and a molecular weight of 207.22 g/mol. Its IUPAC name is 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
PubChem CID103513974
Molecular FormulaC9H15F2NO2
Molecular Weight207.22 g/mol
Exact Mass207.11
IUPAC Name2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
SMILESO=C(NCC1(CO)CCCC1)C(F)F
InChIInChI=1S/C9H15F2NO2/c10-7(11)8(14)12-5-9(6-13)3-1-2-4-9/h7,13H,1-6H2,(H,12,14)
InChIKeyWUAHGNRNCNIWHH-UHFFFAOYSA-N
XLogP0.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.22
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dimethylhexyl)acetamide;(2R)-2-methyl-2-(trifluoromethyl)hexan-1-ol
CID 145149400
ethane;N-(2-methylhexyl)acetamide;(2R)-2-methyl-2-(trifluoromethyl)hexan-1-ol
CID 145149403
3,3,3-trifluoro-N-[(2-hydroxycyclopentyl)methyl]propanamide
CID 65833415
2,2,2-trifluoro-N-[(2-hydroxycyclopentyl)methyl]acetamide
CID 65833844
4,4,4-trifluoro-N-[(2-hydroxycyclopentyl)methyl]butanamide
CID 65834820
2,2,2-trifluoro-N-[[2-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 65926612
4,4-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]cyclohexane-1-carboxamide
CID 81932811
3,3,3-trifluoro-N-[(2-hydroxycyclopentyl)methyl]-2-(trifluoromethyl)propanamide
CID 103310191
3,3,3-trifluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2-(trifluoromethyl)propanamide
CID 103310220
2,2-difluoro-N-[(2-hydroxycyclopentyl)methyl]acetamide
CID 103513942
2,2-difluoro-N-[[2-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 103513943
2,2-difluoro-N-[[1-(hydroxymethyl)cyclohexyl]methyl]acetamide
CID 103513981

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The IUPAC name of 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide (CID 103513974) is 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide.
What is the SMILES notation for 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The canonical SMILES for 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide is O=C(NCC1(CO)CCCC1)C(F)F.
What is the InChIKey of 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The InChIKey is WUAHGNRNCNIWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO2/c10-7(11)8(14)12-5-9(6-13)3-1-2-4-9/h7,13H,1-6H2,(H,12,14).
What are the key properties of 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide has a molecular weight of 207.22 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide is sourced from PubChem (CID 103513974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).