2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide

C16H26N2O2 — CID 78923766

IUPAC2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide
SMILESCCCOc1cc(C)ccc1NC(=O)CNC(C)(C)C
InChIInChI=1S/C16H26N2O2/c1-6-9-20-14-10-12(2)7-8-13(14)18-15(19)11-17-16(3,4)5/h7-8,10,17H,6,9,11H2,1-5H3,(H,18,19)
InChIKeyCXGMAJFEEAACHK-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.11
Rot. Bonds6

About 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide

2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide (PubChem CID 78923766) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide
PubChem CID78923766
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide
SMILESCCCOc1cc(C)ccc1NC(=O)CNC(C)(C)C
InChIInChI=1S/C16H26N2O2/c1-6-9-20-14-10-12(2)7-8-13(14)18-15(19)11-17-16(3,4)5/h7-8,10,17H,6,9,11H2,1-5H3,(H,18,19)
InChIKeyCXGMAJFEEAACHK-UHFFFAOYSA-N
XLogP3.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methyl-2-propoxyphenyl)butanamide
CID 61061572
2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide
CID 61062328
6-(4-methyl-2-propoxyanilino)-6-oxohexanoic acid
CID 60934555
2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide
CID 61062170
2-(4-bromophenoxy)-N-(4-methyl-2-propoxyphenyl)acetamide
CID 55901846
2-hydroxy-2-methyl-3-[(4-methyl-2-propoxyphenyl)carbamoylamino]propanoic acid
CID 122076852
methyl 2-[[2-(tert-butylamino)acetyl]amino]-5-methylbenzoate
CID 78929389
phenyl N-(4-methyl-2-propoxyphenyl)carbamate
CID 61216988
1-(4-methyl-2-propoxyphenyl)-3-(2-methylpropyl)urea
CID 47262023
2-[1-(aminomethyl)cyclobutyl]-N-(4-methyl-2-propoxyphenyl)acetamide
CID 81173247
3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide
CID 54863187
2-[(4-methyl-2-propoxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60934556

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide (CID 78923766) is 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide is CCCOc1cc(C)ccc1NC(=O)CNC(C)(C)C.
What is the InChIKey of 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide?
The InChIKey is CXGMAJFEEAACHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-6-9-20-14-10-12(2)7-8-13(14)18-15(19)11-17-16(3,4)5/h7-8,10,17H,6,9,11H2,1-5H3,(H,18,19).
What are the key properties of 2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide?
2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide has a molecular weight of 278.40 g/mol, XLogP of 3.11, 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-(4-methyl-2-propoxyphenyl)acetamide is sourced from PubChem (CID 78923766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).