2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide

C14H21ClN2O2 — CID 49488972

IUPAC2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CNC(C)(C)C)cc1Cl
InChIInChI=1S/C14H21ClN2O2/c1-5-19-12-7-6-10(8-11(12)15)17-13(18)9-16-14(2,3)4/h6-8,16H,5,9H2,1-4H3,(H,17,18)
InChIKeyWNVXFXUNDPVCOP-UHFFFAOYSA-N
MW284.79 g/mol
LogP3.07
Rot. Bonds5

About 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide

2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide (PubChem CID 49488972) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide
PubChem CID49488972
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CNC(C)(C)C)cc1Cl
InChIInChI=1S/C14H21ClN2O2/c1-5-19-12-7-6-10(8-11(12)15)17-13(18)9-16-14(2,3)4/h6-8,16H,5,9H2,1-4H3,(H,17,18)
InChIKeyWNVXFXUNDPVCOP-UHFFFAOYSA-N
XLogP3.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-(3-chloro-4-ethoxyphenyl)acetamide
CID 60927630
3-amino-N-(3-chloro-4-ethoxyphenyl)-2,2-dimethylpropanamide
CID 81489227
N-(3-chloro-4-ethoxyphenyl)-5-hydroxypentanamide
CID 79199515
2-amino-N-(3-chloro-4-ethoxyphenyl)-2-methylpentanamide;hydrochloride
CID 119715576
3-(3-chloro-4-ethoxyphenyl)-1,1-dimethylurea
CID 19834572
2-(2-aminoethoxy)-N-(3-chloro-4-ethoxyphenyl)acetamide
CID 79472891
N-(3-chloro-4-ethoxyphenyl)-1-cyanoformamide
CID 115171854
2-(3-chloro-4-ethoxyanilino)-N-propylacetamide
CID 87029646
N-(3-chloro-4-ethoxyphenyl)pyridine-4-carboxamide
CID 110777433
N-(3,4-diethoxyphenyl)-2-(methylamino)acetamide
CID 2452186
(2S)-N-(3-chloro-4-ethoxyphenyl)-2-methoxy-2,4-dimethylpentanamide
CID 100696673
2-amino-N-(3-chloro-4-ethoxyphenyl)-3-methylbutanamide
CID 54862511

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide (CID 49488972) is 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)CNC(C)(C)C)cc1Cl.
What is the InChIKey of 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide?
The InChIKey is WNVXFXUNDPVCOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O2/c1-5-19-12-7-6-10(8-11(12)15)17-13(18)9-16-14(2,3)4/h6-8,16H,5,9H2,1-4H3,(H,17,18).
What are the key properties of 2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide?
2-(tert-butylamino)-N-(3-chloro-4-ethoxyphenyl)acetamide has a molecular weight of 284.79 g/mol, XLogP of 3.07, 5 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-chloro-4-ethoxyphenyl)acetamide is sourced from PubChem (CID 49488972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).