N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C20H25N3O4 — CID 20949240

IUPACN-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCCC(C)N(CCNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1
InChIInChI=1S/C20H25N3O4/c1-3-15(2)22(13-16-7-6-12-26-16)11-10-21-19(24)14-23-17-8-4-5-9-18(17)27-20(23)25/h4-9,12,15H,3,10-11,13-14H2,1-2H3,(H,21,24)
InChIKeyGNODFGBZDLTQOW-UHFFFAOYSA-N
MW371.44 g/mol
LogP2.60
Rot. Bonds9

About N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 20949240) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID20949240
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC NameN-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCCC(C)N(CCNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1
InChIInChI=1S/C20H25N3O4/c1-3-15(2)22(13-16-7-6-12-26-16)11-10-21-19(24)14-23-17-8-4-5-9-18(17)27-20(23)25/h4-9,12,15H,3,10-11,13-14H2,1-2H3,(H,21,24)
InChIKeyGNODFGBZDLTQOW-UHFFFAOYSA-N
XLogP2.60
TPSA80.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)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

N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 46522148
N-(furan-2-ylmethyl)-N-(3-methylbutyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 20949234
N-butyl-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 4808042
N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 90605048
N-(2-ethylbutyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 115612682
N-(furan-2-ylmethylcarbamoyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 2124377
N-(4-hydroxypentyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 107299698
N-[3-[benzyl(methyl)amino]propyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 4244209
N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(4-oxo-5H-pyridazino[4,5-b]indol-3-yl)acetamide
CID 135833597
N-(2-methoxyethyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 3580508
2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide
CID 4051540
2-methyl-3-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]propanoic acid
CID 62676565

Frequently Asked Questions

What is the IUPAC name of N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 20949240) is N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is CCC(C)N(CCNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1.
What is the InChIKey of N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is GNODFGBZDLTQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-3-15(2)22(13-16-7-6-12-26-16)11-10-21-19(24)14-23-17-8-4-5-9-18(17)27-20(23)25/h4-9,12,15H,3,10-11,13-14H2,1-2H3,(H,21,24).
What are the key properties of N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 371.44 g/mol, XLogP of 2.60, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 20949240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).