2-ethyl-N,N,5-trimethylaniline

C11H17N — CID 59382459

IUPAC2-ethyl-N,N,5-trimethylaniline
SMILESCCc1ccc(C)cc1N(C)C
InChIInChI=1S/C11H17N/c1-5-10-7-6-9(2)8-11(10)12(3)4/h6-8H,5H2,1-4H3
InChIKeyLXYRLAGOFKUXAJ-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.62
Rot. Bonds2

About 2-ethyl-N,N,5-trimethylaniline

2-ethyl-N,N,5-trimethylaniline (PubChem CID 59382459) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 2-ethyl-N,N,5-trimethylaniline.

Molecular Properties

Compound Name2-ethyl-N,N,5-trimethylaniline
PubChem CID59382459
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name2-ethyl-N,N,5-trimethylaniline
SMILESCCc1ccc(C)cc1N(C)C
InChIInChI=1S/C11H17N/c1-5-10-7-6-9(2)8-11(10)12(3)4/h6-8H,5H2,1-4H3
InChIKeyLXYRLAGOFKUXAJ-UHFFFAOYSA-N
XLogP2.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-ethyl-5-methylphenyl)-N-methylhydroxylamine
CID 145069260
2-[(methoxyamino)methyl]-N,N,5-trimethylaniline
CID 117107463
1,2-diethyl-4-methylbenzene;methane
CID 174446118
1-N-ethyl-2-N,2-N,4-trimethylbenzene-1,2-diamine
CID 59688677
1-ethyl-2,4-dimethylbenzene;propane
CID 143347602
2-fluoro-N,N,5-trimethylaniline
CID 118521335
2-[2-(dimethylamino)-4-(4-methylphenyl)phenyl]acetaldehyde
CID 138645682
2-ethyl-5-methylbenzenethiol
CID 91873863
2,6-dichloro-N-[[2-(dimethylamino)-4-methylphenyl]methyl]pyridine-4-carboxamide
CID 167845702
1-[[2-(dimethylamino)-4-methylphenyl]methyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111976814
2-ethyl-N,N-dihydroxy-4-methylaniline;hydrochloride
CID 175909559
ethane;2-ethyl-5-methylphenol
CID 142001660

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N,5-trimethylaniline?
The IUPAC name of 2-ethyl-N,N,5-trimethylaniline (CID 59382459) is 2-ethyl-N,N,5-trimethylaniline.
What is the SMILES notation for 2-ethyl-N,N,5-trimethylaniline?
The canonical SMILES for 2-ethyl-N,N,5-trimethylaniline is CCc1ccc(C)cc1N(C)C.
What is the InChIKey of 2-ethyl-N,N,5-trimethylaniline?
The InChIKey is LXYRLAGOFKUXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-5-10-7-6-9(2)8-11(10)12(3)4/h6-8H,5H2,1-4H3.
What are the key properties of 2-ethyl-N,N,5-trimethylaniline?
2-ethyl-N,N,5-trimethylaniline has a molecular weight of 163.26 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N,5-trimethylaniline is sourced from PubChem (CID 59382459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).