N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide

C13H16F2N2O2 — CID 43405257

IUPACN-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide
SMILESO=C(CNCC1CCCO1)Nc1c(F)cccc1F
InChIInChI=1S/C13H16F2N2O2/c14-10-4-1-5-11(15)13(10)17-12(18)8-16-7-9-3-2-6-19-9/h1,4-5,9,16H,2-3,6-8H2,(H,17,18)
InChIKeyLNUKFQWXGJWHAT-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.67
Rot. Bonds5

About N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide

N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide (PubChem CID 43405257) has the molecular formula C13H16F2N2O2 and a molecular weight of 270.28 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide
PubChem CID43405257
Molecular FormulaC13H16F2N2O2
Molecular Weight270.28 g/mol
Exact Mass270.12
IUPAC NameN-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide
SMILESO=C(CNCC1CCCO1)Nc1c(F)cccc1F
InChIInChI=1S/C13H16F2N2O2/c14-10-4-1-5-11(15)13(10)17-12(18)8-16-7-9-3-2-6-19-9/h1,4-5,9,16H,2-3,6-8H2,(H,17,18)
InChIKeyLNUKFQWXGJWHAT-UHFFFAOYSA-N
XLogP1.67
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide 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

N-(2-ethyl-6-methylphenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54815604
2-(cyclohexylmethylamino)-N-(2,6-difluorophenyl)acetamide
CID 43405285
N-(2,3-dimethylphenyl)-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 2078790
N-(2,6-difluorophenyl)-2-(thiolan-2-ylmethylamino)acetamide
CID 80585451
N-(4-acetamidophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54815392
N-(2,6-dimethylphenyl)-3-(oxolan-2-ylmethylamino)propanamide
CID 109016069
N-[3-[[2-(oxolan-2-ylmethylamino)acetyl]amino]phenyl]butanamide
CID 54815821
N-(4-iodophenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119672668
N-(2-cyanophenyl)-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 1439761
N-(4-methylsulfanylphenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119694259
N-[2-(2-fluorophenoxy)ethyl]-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119681187
2-(oxolan-2-ylmethylamino)-N-(2-pyrrol-1-ylphenyl)acetamide
CID 645953

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide (CID 43405257) is N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide is O=C(CNCC1CCCO1)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide?
The InChIKey is LNUKFQWXGJWHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O2/c14-10-4-1-5-11(15)13(10)17-12(18)8-16-7-9-3-2-6-19-9/h1,4-5,9,16H,2-3,6-8H2,(H,17,18).
What are the key properties of N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide?
N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide has a molecular weight of 270.28 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide is sourced from PubChem (CID 43405257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).