N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide

C18H25N3O2 — CID 51291858

IUPACN-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide
SMILESCCN(CC(=O)NC(C)(C)C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C18H25N3O2/c1-5-21(13-17(22)19-18(2,3)4)12-15-11-16(20-23-15)14-9-7-6-8-10-14/h6-11H,5,12-13H2,1-4H3,(H,19,22)
InChIKeyARMSICRONMLRND-UHFFFAOYSA-N
MW315.42 g/mol
LogP3.08
Rot. Bonds6

About N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide

N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide (PubChem CID 51291858) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide
PubChem CID51291858
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide
SMILESCCN(CC(=O)NC(C)(C)C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C18H25N3O2/c1-5-21(13-17(22)19-18(2,3)4)12-15-11-16(20-23-15)14-9-7-6-8-10-14/h6-11H,5,12-13H2,1-4H3,(H,19,22)
InChIKeyARMSICRONMLRND-UHFFFAOYSA-N
XLogP3.08
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]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

2-[(3-phenyl-1,2-oxazol-5-yl)methyl-propylamino]acetic acid
CID 61006913
2-[2-methylpropyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetic acid
CID 63065042
2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
CID 15761396
2-(diethylamino)-N-[[3-(4-iodophenyl)-1,2-oxazol-5-yl]methyl]acetamide
CID 51039200
N-tert-butyl-2-[(2-chloroquinolin-3-yl)methyl-ethylamino]acetamide
CID 8794209
N-tert-butyl-2-[(3-chlorophenyl)methyl-ethylamino]acetamide
CID 78791266
N-(3-chlorophenyl)-2-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide
CID 37131235
N'-methyl-N'-[(3-phenyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 62686446
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-3-(propanoylamino)benzamide
CID 46989874
N-tert-butyl-2-(diethylamino)acetamide;hydrochloride
CID 138397018
N-tert-butyl-2-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl-ethylamino]acetamide
CID 8795767

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide?
The IUPAC name of N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide (CID 51291858) is N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide is CCN(CC(=O)NC(C)(C)C)Cc1cc(-c2ccccc2)no1.
What is the InChIKey of N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide?
The InChIKey is ARMSICRONMLRND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-5-21(13-17(22)19-18(2,3)4)12-15-11-16(20-23-15)14-9-7-6-8-10-14/h6-11H,5,12-13H2,1-4H3,(H,19,22).
What are the key properties of N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide?
N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide has a molecular weight of 315.42 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetamide is sourced from PubChem (CID 51291858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).