2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide

C19H25N3O3 — CID 53195598

IUPAC2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide
SMILESCCN(CC)C(=O)c1nc(CNC(=O)c2cc(C)cc(C)c2)oc1C
InChIInChI=1S/C19H25N3O3/c1-6-22(7-2)19(24)17-14(5)25-16(21-17)11-20-18(23)15-9-12(3)8-13(4)10-15/h8-10H,6-7,11H2,1-5H3,(H,20,23)
InChIKeyTXOSATAZSRFNBE-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.01
Rot. Bonds6

About 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide

2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide (PubChem CID 53195598) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide
PubChem CID53195598
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide
SMILESCCN(CC)C(=O)c1nc(CNC(=O)c2cc(C)cc(C)c2)oc1C
InChIInChI=1S/C19H25N3O3/c1-6-22(7-2)19(24)17-14(5)25-16(21-17)11-20-18(23)15-9-12(3)8-13(4)10-15/h8-10H,6-7,11H2,1-5H3,(H,20,23)
InChIKeyTXOSATAZSRFNBE-UHFFFAOYSA-N
XLogP3.01
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide 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,N-diethyl-2-[(1H-indazole-3-carbonylamino)methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 53195608
N,N-diethyl-5-methyl-2-[(quinoline-2-carbonylamino)methyl]-1,3-oxazole-4-carboxamide
CID 53195593
2-[[(4-chlorophenyl)sulfonylamino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide
CID 53195616
N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylbenzamide
CID 51161803
4-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,5-difluorobenzamide
CID 106377408
3-bromo-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]benzamide
CID 47344966
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-fluoro-4-methylbenzamide
CID 47345055
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-sulfanylbenzamide
CID 106377771
5-(diethylsulfamoyl)-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-methylbenzamide
CID 87043361
3-fluoro-N-[[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide
CID 53195374
3-chloro-N-[[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide
CID 53195398
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,4-dimethoxybenzamide
CID 87043417

Frequently Asked Questions

What is the IUPAC name of 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide (CID 53195598) is 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide is CCN(CC)C(=O)c1nc(CNC(=O)c2cc(C)cc(C)c2)oc1C.
What is the InChIKey of 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is TXOSATAZSRFNBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-6-22(7-2)19(24)17-14(5)25-16(21-17)11-20-18(23)15-9-12(3)8-13(4)10-15/h8-10H,6-7,11H2,1-5H3,(H,20,23).
What are the key properties of 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide?
2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3,5-dimethylbenzoyl)amino]methyl]-N,N-diethyl-5-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 53195598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).