N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide

C8H7F3N2O — CID 144611139

IUPACN-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide
SMILESO=CNCc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H7F3N2O/c9-8(10,11)7-3-1-2-6(13-7)4-12-5-14/h1-3,5H,4H2,(H,12,14)
InChIKeyVFTIPWSBWPJQAA-UHFFFAOYSA-N
MW204.15 g/mol
LogP1.35
Rot. Bonds3

About N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide

N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide (PubChem CID 144611139) has the molecular formula C8H7F3N2O and a molecular weight of 204.15 g/mol. Its IUPAC name is N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide.

Molecular Properties

Compound NameN-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide
PubChem CID144611139
Molecular FormulaC8H7F3N2O
Molecular Weight204.15 g/mol
Exact Mass204.05
IUPAC NameN-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide
SMILESO=CNCc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H7F3N2O/c9-8(10,11)7-3-1-2-6(13-7)4-12-5-14/h1-3,5H,4H2,(H,12,14)
InChIKeyVFTIPWSBWPJQAA-UHFFFAOYSA-N
XLogP1.35
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.15
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]propanamide
CID 123230614
2-[6-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 53401513
2-butyl-6-(trifluoromethyl)pyridine
CID 126570654
2,2-dimethyl-3-[6-(trifluoromethyl)-2-pyridinyl]propanoic acid
CID 171538306
1-[2-[2-(trifluoromethyl)phenyl]ethyl]-3-[[6-(trifluoromethyl)-2-pyridinyl]methyl]urea
CID 166236084
2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]acetaldehyde
CID 155753759
N-[(4-tert-butylphenyl)methyl]-2-[6-(trifluoromethyl)-2-pyridinyl]acetamide
CID 68701165
N-[[6-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]-2-pyridinyl]methyl]formamide
CID 144826593
N-[(6-thiophen-3-yl-2-pyridinyl)methyl]formamide
CID 174726356
3-(ethoxymethyl)-N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide
CID 154846592
N-(pyridazin-3-ylmethyl)formamide
CID 23498776
6-(trifluoromethyl)pyridine-2-carbonyl fluoride
CID 174756442

Frequently Asked Questions

What is the IUPAC name of N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide?
The IUPAC name of N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide (CID 144611139) is N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide.
What is the SMILES notation for N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide?
The canonical SMILES for N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide is O=CNCc1cccc(C(F)(F)F)n1.
What is the InChIKey of N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide?
The InChIKey is VFTIPWSBWPJQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O/c9-8(10,11)7-3-1-2-6(13-7)4-12-5-14/h1-3,5H,4H2,(H,12,14).
What are the key properties of N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide?
N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide has a molecular weight of 204.15 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]formamide is sourced from PubChem (CID 144611139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).