N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide

C20H30N4O2 — CID 60536649

IUPACN-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide
SMILESCCN(CC)Cc1ccccc1NCC(=O)Nc1cc(C(C)(C)C)no1
InChIInChI=1S/C20H30N4O2/c1-6-24(7-2)14-15-10-8-9-11-16(15)21-13-18(25)22-19-12-17(23-26-19)20(3,4)5/h8-12,21H,6-7,13-14H2,1-5H3,(H,22,25)
InChIKeyVDOJEFAJCXEYLN-UHFFFAOYSA-N
MW358.49 g/mol
LogP3.86
Rot. Bonds8

About N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide

N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide (PubChem CID 60536649) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide
PubChem CID60536649
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide
SMILESCCN(CC)Cc1ccccc1NCC(=O)Nc1cc(C(C)(C)C)no1
InChIInChI=1S/C20H30N4O2/c1-6-24(7-2)14-15-10-8-9-11-16(15)21-13-18(25)22-19-12-17(23-26-19)20(3,4)5/h8-12,21H,6-7,13-14H2,1-5H3,(H,22,25)
InChIKeyVDOJEFAJCXEYLN-UHFFFAOYSA-N
XLogP3.86
TPSA70.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(diethylaminomethyl)anilino]-N-(2-iodophenyl)acetamide
CID 55898056
2-[2-(diethylaminomethyl)anilino]-N-[1-(3,4-dimethylphenyl)ethyl]acetamide
CID 60536828
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[ethyl-[(3-fluorophenyl)methyl]amino]acetamide
CID 18088803
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(N-methylanilino)acetamide
CID 18087249
methyl 4-[[2-[2-(diethylaminomethyl)anilino]acetyl]amino]benzoate
CID 60536782
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[ethyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]acetamide
CID 135848614
N-(4-chloro-2,5-dimethoxyphenyl)-2-[2-(diethylaminomethyl)anilino]acetamide
CID 55897928
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-chlorophenyl)acetamide
CID 59420457
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 8794463
ethane;N-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]propanamide
CID 170582956
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[[(1S)-1-naphthalen-1-ylethyl]amino]acetamide
CID 8695440
2-(2-iodoanilino)-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 31691858

Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide?
The IUPAC name of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide (CID 60536649) is N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide.
What is the SMILES notation for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide?
The canonical SMILES for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide is CCN(CC)Cc1ccccc1NCC(=O)Nc1cc(C(C)(C)C)no1.
What is the InChIKey of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide?
The InChIKey is VDOJEFAJCXEYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-6-24(7-2)14-15-10-8-9-11-16(15)21-13-18(25)22-19-12-17(23-26-19)20(3,4)5/h8-12,21H,6-7,13-14H2,1-5H3,(H,22,25).
What are the key properties of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide?
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide has a molecular weight of 358.49 g/mol, XLogP of 3.86, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[2-(diethylaminomethyl)anilino]acetamide is sourced from PubChem (CID 60536649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).