N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide

C16H26N2O — CID 115158146

IUPACN-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide
SMILESCCNCC(=O)NCC(C)(C)c1ccc(C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-6-17-10-15(19)18-11-16(4,5)14-8-7-12(2)13(3)9-14/h7-9,17H,6,10-11H2,1-5H3,(H,18,19)
InChIKeySPKYQTRHIGQWGH-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.31
Rot. Bonds6

About N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide

N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide (PubChem CID 115158146) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide
PubChem CID115158146
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide
SMILESCCNCC(=O)NCC(C)(C)c1ccc(C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-6-17-10-15(19)18-11-16(4,5)14-8-7-12(2)13(3)9-14/h7-9,17H,6,10-11H2,1-5H3,(H,18,19)
InChIKeySPKYQTRHIGQWGH-UHFFFAOYSA-N
XLogP2.31
TPSA41.13 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 ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyano-N-[2-(3,4-dimethylphenyl)-2-methylpropyl]acetamide
CID 115173409
2-(methylamino)-N-[2-methyl-2-(4-methylphenyl)propyl]acetamide
CID 115152154
N-[2-(4-tert-butylphenyl)ethyl]-2-(ethylamino)acetamide
CID 115158005
N-[2-(2-bromophenyl)-2-methylpropyl]-2-(ethylamino)acetamide
CID 115158174
2-(2-methoxyethylamino)-N-[2-methyl-2-(3-methylphenyl)propyl]acetamide;hydrochloride
CID 119757019
2-(ethylamino)-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65106281
2-[(3,4-dimethylphenyl)methylamino]-N-ethylacetamide
CID 43221669
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152169
N-(chloromethyl)-2-(3,4-dimethylphenyl)-2-methylpropan-1-amine
CID 115263613
[2-(4-fluoro-3-methylphenyl)-2-methylpropyl]carbamic acid
CID 115171370
N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119802083
N-[2-(3-bromo-4-methoxyphenyl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152172

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide?
The IUPAC name of N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide (CID 115158146) is N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide.
What is the SMILES notation for N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide?
The canonical SMILES for N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide is CCNCC(=O)NCC(C)(C)c1ccc(C)c(C)c1.
What is the InChIKey of N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide?
The InChIKey is SPKYQTRHIGQWGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-6-17-10-15(19)18-11-16(4,5)14-8-7-12(2)13(3)9-14/h7-9,17H,6,10-11H2,1-5H3,(H,18,19).
What are the key properties of N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide?
N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide has a molecular weight of 262.40 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dimethylphenyl)-2-methylpropyl]-2-(ethylamino)acetamide is sourced from PubChem (CID 115158146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).