N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide

C16H26N2O — CID 81484732

IUPACN-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCCC(N)(CC)CNC(=O)Cc1ccc(C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-5-16(17,6-2)11-18-15(19)10-14-8-7-12(3)13(4)9-14/h7-9H,5-6,10-11,17H2,1-4H3,(H,18,19)
InChIKeyKWTPFAOGPUORNU-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.48
Rot. Bonds6

About N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide

N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide (PubChem CID 81484732) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide
PubChem CID81484732
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCCC(N)(CC)CNC(=O)Cc1ccc(C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-5-16(17,6-2)11-18-15(19)10-14-8-7-12(3)13(4)9-14/h7-9H,5-6,10-11,17H2,1-4H3,(H,18,19)
InChIKeyKWTPFAOGPUORNU-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-ethylbutyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 119261247
N-(2-amino-2-ethylbutyl)-2-(3,4-dimethoxyphenyl)acetamide;hydrochloride
CID 119641340
N-(2-amino-2-ethylbutyl)-3,4-dimethylbenzamide
CID 81484563
N-(2-amino-2-ethylbutyl)-2-(4-aminophenyl)acetamide
CID 122080857
N-(2-amino-2-ethylbutyl)-2-(2,5-dimethylphenyl)acetamide;hydrochloride
CID 119643056
N-(2-amino-2-ethylbutyl)-2-(4-chlorophenyl)acetamide
CID 81484294
N-(2-amino-2-ethylbutyl)-2-(4-nitrophenyl)acetamide
CID 81484734
N-(2-amino-2-ethylbutyl)-2-(3-methoxyphenyl)acetamide;hydrochloride
CID 119639628
N-(2-amino-2-ethylbutyl)-2-thiophen-3-ylacetamide;hydrochloride
CID 119641880
N-(2-amino-2-ethylbutyl)-2-(4-nitrophenyl)acetamide;hydrochloride
CID 119642438
2-[[2-(3,4-dimethylphenyl)acetyl]amino]acetic acid
CID 60657051
N-(2-amino-2-ethylbutyl)-2-[4-(difluoromethylsulfonyl)phenyl]acetamide
CID 119641229

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide (CID 81484732) is N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide is CCC(N)(CC)CNC(=O)Cc1ccc(C)c(C)c1.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide?
The InChIKey is KWTPFAOGPUORNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-16(17,6-2)11-18-15(19)10-14-8-7-12(3)13(4)9-14/h7-9H,5-6,10-11,17H2,1-4H3,(H,18,19).
What are the key properties of N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide?
N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide has a molecular weight of 262.40 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2-(3,4-dimethylphenyl)acetamide is sourced from PubChem (CID 81484732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).