2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide

C15H20F2N2O2 — CID 81265246

IUPAC2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide
SMILESCCCNC(COc1c(F)cccc1F)(C(N)=O)C1CC1
InChIInChI=1S/C15H20F2N2O2/c1-2-8-19-15(14(18)20,10-6-7-10)9-21-13-11(16)4-3-5-12(13)17/h3-5,10,19H,2,6-9H2,1H3,(H2,18,20)
InChIKeyXFEWWOXIDVTPOY-UHFFFAOYSA-N
MW298.33 g/mol
LogP1.98
Rot. Bonds8

About 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide

2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide (PubChem CID 81265246) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide
PubChem CID81265246
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC Name2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide
SMILESCCCNC(COc1c(F)cccc1F)(C(N)=O)C1CC1
InChIInChI=1S/C15H20F2N2O2/c1-2-8-19-15(14(18)20,10-6-7-10)9-21-13-11(16)4-3-5-12(13)17/h3-5,10,19H,2,6-9H2,1H3,(H2,18,20)
InChIKeyXFEWWOXIDVTPOY-UHFFFAOYSA-N
XLogP1.98
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide 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

3-(2,6-difluorophenoxy)-2-methyl-2-(propylamino)propanoic acid
CID 81269915
2-cyclopropyl-3-(oxan-4-ylmethoxy)-2-(propylamino)propanamide
CID 63920997
5-(2,6-difluorophenoxy)-2-methyl-2-(propylamino)pentanamide
CID 81265267
2-(cyclopropylamino)-3-(2,6-difluorophenoxy)-2-methylpropanamide
CID 81269914
2-cyclopropyl-3-(2-methylpentoxy)-2-(propylamino)propanamide
CID 103285031
2-cyclopropyl-2-(2-fluoroanilino)butanamide
CID 64920389
2-cyclopropyl-3-(2-ethylimidazol-1-yl)-2-(propylamino)propanamide
CID 63919908
2-cyclopropyl-3-(2-fluoro-6-nitrophenoxy)-2-(methylamino)propanoic acid
CID 104832324
2-amino-2-cyclopropyl-3-(2,6-difluorophenoxy)propan-1-ol
CID 81269349
2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
CID 63921557
3-butoxy-2-cyclopropyl-2-(ethylamino)propanamide
CID 63918660
2-cyclopropyl-3-(2,2-difluoroethoxy)-2-(propylamino)propanoic acid
CID 82007448

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide (CID 81265246) is 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide is CCCNC(COc1c(F)cccc1F)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide?
The InChIKey is XFEWWOXIDVTPOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c1-2-8-19-15(14(18)20,10-6-7-10)9-21-13-11(16)4-3-5-12(13)17/h3-5,10,19H,2,6-9H2,1H3,(H2,18,20).
What are the key properties of 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide?
2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide has a molecular weight of 298.33 g/mol, XLogP of 1.98, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(2,6-difluorophenoxy)-2-(propylamino)propanamide is sourced from PubChem (CID 81265246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).