N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide

C10H16F3NO — CID 103766554

IUPACN-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide
SMILESCCC1(CNC(=O)C(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)7-14-8(15)10(11,12)13/h2-7H2,1H3,(H,14,15)
InChIKeyVDIKFEAOJRSHDQ-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.64
Rot. Bonds3

About N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide

N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide (PubChem CID 103766554) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide
PubChem CID103766554
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC NameN-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide
SMILESCCC1(CNC(=O)C(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)7-14-8(15)10(11,12)13/h2-7H2,1H3,(H,14,15)
InChIKeyVDIKFEAOJRSHDQ-UHFFFAOYSA-N
XLogP2.64
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-methylpropanamide
CID 106509811
2-(aminomethyl)-2-ethyl-N-[(1-ethylcyclopropyl)methyl]butanamide
CID 103840339
2-[(1-ethylcyclopentyl)methylamino]-2-oxoacetic acid
CID 104768310
2-carbamothioyl-N-[(1-ethylcyclopentyl)methyl]-2-methylbutanamide
CID 114125492
2-amino-N-[(1-ethylcyclopentyl)methyl]acetamide
CID 103797853
3-[(1-ethylcyclopentyl)methyl]-1,1-dimethylurea
CID 103764918
N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide
CID 115673150
N-[(1-ethylcyclopentyl)methyl]-2-(methylamino)acetamide
CID 103812596
2-amino-3,3,3-trifluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2-methylpropanamide
CID 113293905
1-butyl-3-[(1-ethylcyclobutyl)methyl]urea
CID 103740930
2-(aminomethyl)-2-ethyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]butanamide
CID 113309032
N-[(1-ethylcyclobutyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 103810906

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide?
The IUPAC name of N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide (CID 103766554) is N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide?
The canonical SMILES for N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide is CCC1(CNC(=O)C(F)(F)F)CCCC1.
What is the InChIKey of N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide?
The InChIKey is VDIKFEAOJRSHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)7-14-8(15)10(11,12)13/h2-7H2,1H3,(H,14,15).
What are the key properties of N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide?
N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide has a molecular weight of 223.24 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide is sourced from PubChem (CID 103766554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).