2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide

C15H24N2O — CID 28794600

IUPAC2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide
SMILESCC(C)c1cccc(C(C)C)c1N(C)C(=O)CN
InChIInChI=1S/C15H24N2O/c1-10(2)12-7-6-8-13(11(3)4)15(12)17(5)14(18)9-16/h6-8,10-11H,9,16H2,1-5H3
InChIKeyUTXGAUFITOFQAS-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.85
Rot. Bonds4

About 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide

2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide (PubChem CID 28794600) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide.

Molecular Properties

Compound Name2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide
PubChem CID28794600
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide
SMILESCC(C)c1cccc(C(C)C)c1N(C)C(=O)CN
InChIInChI=1S/C15H24N2O/c1-10(2)12-7-6-8-13(11(3)4)15(12)17(5)14(18)9-16/h6-8,10-11H,9,16H2,1-5H3
InChIKeyUTXGAUFITOFQAS-UHFFFAOYSA-N
XLogP2.85
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,6-difluorophenyl)-N-methylacetamide
CID 28794668
3-amino-N-methyl-N-(2-propan-2-ylphenyl)propanamide
CID 28795019
methyl 2-(2-hydroxy-3-propan-2-ylphenyl)propanoate
CID 163214418
2-amino-N-methyl-N-(3-methylphenyl)acetamide
CID 28794377
2-amino-N-methyl-N-(2-methylphenyl)acetamide
CID 28794373
(Z)-N,N'-bis[2,6-di(propan-2-yl)phenyl]-N,N'-dimethylethene-1,2-diamine
CID 90429610
2-amino-N-methyl-N-(4-methylphenyl)acetamide
CID 22617441
2-[2,6-di(propan-2-yl)phenyl]acetyl chloride
CID 19362782
N,N'-bis[2,6-di(propan-2-yl)phenyl]-N,N'-bis(trimethylsilyl)ethane-1,2-diamine
CID 22251744
1-[2,6-di(propan-2-yl)phenyl]-1-(4-propan-2-ylphenyl)urea
CID 141049906
N-methyl-N-propan-2-yl-2-(2-propan-2-ylphenyl)acetamide
CID 59961759
2-[(1S)-1,2-diaminoethyl]-6-propan-2-ylphenol
CID 55262533

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide?
The IUPAC name of 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide (CID 28794600) is 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide.
What is the SMILES notation for 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide?
The canonical SMILES for 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide is CC(C)c1cccc(C(C)C)c1N(C)C(=O)CN.
What is the InChIKey of 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide?
The InChIKey is UTXGAUFITOFQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)12-7-6-8-13(11(3)4)15(12)17(5)14(18)9-16/h6-8,10-11H,9,16H2,1-5H3.
What are the key properties of 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide?
2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide has a molecular weight of 248.37 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2,6-di(propan-2-yl)phenyl]-N-methylacetamide is sourced from PubChem (CID 28794600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).