4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide

C13H18F2N2O2 — CID 63183722

IUPAC4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
SMILESCCNc1c(F)cc(C(=O)NC(C)COC)cc1F
InChIInChI=1S/C13H18F2N2O2/c1-4-16-12-10(14)5-9(6-11(12)15)13(18)17-8(2)7-19-3/h5-6,8,16H,4,7H2,1-3H3,(H,17,18)
InChIKeyRJGAUDYBXCUBNS-UHFFFAOYSA-N
MW272.29 g/mol
LogP2.16
Rot. Bonds6

About 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide

4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide (PubChem CID 63183722) has the molecular formula C13H18F2N2O2 and a molecular weight of 272.29 g/mol. Its IUPAC name is 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide.

Molecular Properties

Compound Name4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
PubChem CID63183722
Molecular FormulaC13H18F2N2O2
Molecular Weight272.29 g/mol
Exact Mass272.13
IUPAC Name4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
SMILESCCNc1c(F)cc(C(=O)NC(C)COC)cc1F
InChIInChI=1S/C13H18F2N2O2/c1-4-16-12-10(14)5-9(6-11(12)15)13(18)17-8(2)7-19-3/h5-6,8,16H,4,7H2,1-3H3,(H,17,18)
InChIKeyRJGAUDYBXCUBNS-UHFFFAOYSA-N
XLogP2.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.29
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide 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

4-(ethylamino)-3,5-difluoro-N-pentan-2-ylbenzamide
CID 63184100
4-amino-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
CID 55158856
4-(ethylamino)-3,5-difluoro-N-[1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 63185971
4-(ethylamino)-3,5-difluoro-N-methylbenzamide
CID 63187176
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide
CID 30481549
4-fluoro-N-(1-methoxypropan-2-yl)-3-sulfanylbenzamide
CID 107020016
N-ethyl-4-(ethylamino)-3,5-difluoro-N-(2-methoxyethyl)benzamide
CID 63185704
3,5-difluoro-N-(4-methylpentan-2-yl)-4-(propylamino)benzamide
CID 63185041
3-bromo-5-chloro-N-(1-methoxypropan-2-yl)benzamide
CID 103826410
4-(ethylamino)-3,5-difluoro-N',N'-dimethylbenzohydrazide
CID 83025049
4-amino-3,5-dichloro-N-(1-methoxypropan-2-yl)benzamide
CID 82787029

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide?
The IUPAC name of 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide (CID 63183722) is 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide.
What is the SMILES notation for 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide?
The canonical SMILES for 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide is CCNc1c(F)cc(C(=O)NC(C)COC)cc1F.
What is the InChIKey of 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide?
The InChIKey is RJGAUDYBXCUBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F2N2O2/c1-4-16-12-10(14)5-9(6-11(12)15)13(18)17-8(2)7-19-3/h5-6,8,16H,4,7H2,1-3H3,(H,17,18).
What are the key properties of 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide?
4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide has a molecular weight of 272.29 g/mol, XLogP of 2.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide is sourced from PubChem (CID 63183722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).