2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide

C9H12FN3O — CID 62734537

IUPAC2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ncccc1F
InChIInChI=1S/C9H12FN3O/c1-13(2)8(14)6-12-9-7(10)4-3-5-11-9/h3-5H,6H2,1-2H3,(H,11,12)
InChIKeyOHBFEJHFTHVSKN-UHFFFAOYSA-N
MW197.21 g/mol
LogP0.72
Rot. Bonds3

About 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide

2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide (PubChem CID 62734537) has the molecular formula C9H12FN3O and a molecular weight of 197.21 g/mol. Its IUPAC name is 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide
PubChem CID62734537
Molecular FormulaC9H12FN3O
Molecular Weight197.21 g/mol
Exact Mass197.10
IUPAC Name2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ncccc1F
InChIInChI=1S/C9H12FN3O/c1-13(2)8(14)6-12-9-7(10)4-3-5-11-9/h3-5H,6H2,1-2H3,(H,11,12)
InChIKeyOHBFEJHFTHVSKN-UHFFFAOYSA-N
XLogP0.72
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide 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-[(3-bromo-2-pyridinyl)amino]-N,N-dimethylacetamide
CID 61375232
2-[[2-(dimethylamino)-2-oxoethyl]amino]pyridine-3-carboxamide
CID 43311020
N,N-dimethyl-2-[(3-nitro-2-pyridinyl)amino]acetamide
CID 9339733
3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617514
N,N-diethyl-3-[(3-fluoro-2-pyridinyl)amino]propanamide
CID 62734354
3-[(3-fluoro-2-pyridinyl)amino]-N-methylpropanamide
CID 62732862
1-(dimethylamino)-3-[(3-fluoro-2-pyridinyl)amino]-2-methylpropan-2-ol
CID 103837833
N-(3-fluoro-2-pyridinyl)propanamide
CID 130249129
[4-[[(3-fluoro-2-pyridinyl)amino]methyl]phenyl]methanol
CID 107232296
N,N-dimethyl-2-(pyridazin-3-ylamino)acetamide
CID 62482830
3-fluoro-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 62733415
methyl 6-[(3-fluoro-2-pyridinyl)amino]hexanoate
CID 62734562

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide (CID 62734537) is 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide is CN(C)C(=O)CNc1ncccc1F.
What is the InChIKey of 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide?
The InChIKey is OHBFEJHFTHVSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN3O/c1-13(2)8(14)6-12-9-7(10)4-3-5-11-9/h3-5H,6H2,1-2H3,(H,11,12).
What are the key properties of 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide?
2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide has a molecular weight of 197.21 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 62734537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).