2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide

C15H24N2O2 — CID 112730361

IUPAC2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(CNC(=O)CNC(C)(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-5-19-13-8-6-7-12(9-13)10-16-14(18)11-17-15(2,3)4/h6-9,17H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyUBNOMEFEIVSHNT-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds6

About 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide

2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide (PubChem CID 112730361) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
PubChem CID112730361
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(CNC(=O)CNC(C)(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-5-19-13-8-6-7-12(9-13)10-16-14(18)11-17-15(2,3)4/h6-9,17H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyUBNOMEFEIVSHNT-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]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

3-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]propanamide
CID 60872199
2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
CID 60873169
N-[(3-ethoxyphenyl)methyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 56540336
6-amino-N-[(3-ethoxyphenyl)methyl]-4,4-dimethylhexanamide
CID 65290667
2-[3-[(tert-butylamino)methyl]phenoxy]-N-ethylacetamide
CID 63057746
N-[(3-ethoxyphenyl)methyl]-4-hydroxybutanamide
CID 79191557
5-chloro-N-[(3-ethoxyphenyl)methyl]pentanamide
CID 60872587
3-chloro-N-[(3-ethoxyphenyl)methyl]-2,2-dimethylpropanamide
CID 55245625
3-amino-N-[(3-ethoxyphenyl)methyl]-2,2-dimethylpropanamide
CID 81489935
6-[(3-ethoxyphenyl)methylamino]-6-oxohexanoic acid
CID 60872975
N-[2-[(3-ethoxyphenyl)methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78900659
2-[2-[(3-ethoxyphenyl)methylamino]-2-oxoethyl]sulfanylacetic acid
CID 112685361

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide (CID 112730361) is 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide is CCOc1cccc(CNC(=O)CNC(C)(C)C)c1.
What is the InChIKey of 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The InChIKey is UBNOMEFEIVSHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-19-13-8-6-7-12(9-13)10-16-14(18)11-17-15(2,3)4/h6-9,17H,5,10-11H2,1-4H3,(H,16,18).
What are the key properties of 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 112730361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).