N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline

C14H18N2O3S — CID 103764564

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline
SMILESCCc1cnc(CNc2ccc(S(=O)(=O)CC)cc2)o1
InChIInChI=1S/C14H18N2O3S/c1-3-12-9-16-14(19-12)10-15-11-5-7-13(8-6-11)20(17,18)4-2/h5-9,15H,3-4,10H2,1-2H3
InChIKeyYEWGLZCAEKSALO-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.64
Rot. Bonds6

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline (PubChem CID 103764564) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline
PubChem CID103764564
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline
SMILESCCc1cnc(CNc2ccc(S(=O)(=O)CC)cc2)o1
InChIInChI=1S/C14H18N2O3S/c1-3-12-9-16-14(19-12)10-15-11-5-7-13(8-6-11)20(17,18)4-2/h5-9,15H,3-4,10H2,1-2H3
InChIKeyYEWGLZCAEKSALO-UHFFFAOYSA-N
XLogP2.64
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline 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

6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-sulfonamide
CID 106368950
3-amino-4-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-N-methylbenzenesulfonamide
CID 106369348
4-ethylsulfonyl-N-[(5-iodofuran-2-yl)methyl]aniline
CID 43782384
N-methyl-4-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzenesulfonamide
CID 106373911
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-(methylaminomethyl)benzenesulfonamide
CID 106373721
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylpropan-2-amine
CID 65184221
4-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-(trifluoromethyl)benzene-1,4-diamine
CID 106369393
4-ethylsulfonyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]aniline
CID 103895801
2-chloro-4-[(5-ethyl-1,3-oxazol-2-yl)methylamino]benzonitrile
CID 103764561
4-(2-aminoethyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]benzenesulfonamide
CID 106373743
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine
CID 114180523
5-amino-2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-N-methylbenzenesulfonamide
CID 106369551

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline (CID 103764564) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline is CCc1cnc(CNc2ccc(S(=O)(=O)CC)cc2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline?
The InChIKey is YEWGLZCAEKSALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-3-12-9-16-14(19-12)10-15-11-5-7-13(8-6-11)20(17,18)4-2/h5-9,15H,3-4,10H2,1-2H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline has a molecular weight of 294.38 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-ethylsulfonylaniline is sourced from PubChem (CID 103764564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).