N,2-diethyl-4-methylaniline

C11H17N — CID 23348946

IUPACN,2-diethyl-4-methylaniline
SMILESCCNc1ccc(C)cc1CC
InChIInChI=1S/C11H17N/c1-4-10-8-9(3)6-7-11(10)12-5-2/h6-8,12H,4-5H2,1-3H3
InChIKeyRJLTZZDHNSWOSM-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.99
Rot. Bonds3

About N,2-diethyl-4-methylaniline

N,2-diethyl-4-methylaniline (PubChem CID 23348946) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is N,2-diethyl-4-methylaniline.

Molecular Properties

Compound NameN,2-diethyl-4-methylaniline
PubChem CID23348946
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC NameN,2-diethyl-4-methylaniline
SMILESCCNc1ccc(C)cc1CC
InChIInChI=1S/C11H17N/c1-4-10-8-9(3)6-7-11(10)12-5-2/h6-8,12H,4-5H2,1-3H3
InChIKeyRJLTZZDHNSWOSM-UHFFFAOYSA-N
XLogP2.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,2-diethyl-5-methylaniline;ethane
CID 143835073
1-N-ethyl-2-N,2-N,4-trimethylbenzene-1,2-diamine
CID 59688677
N,2-diethyl-4-fluoroaniline
CID 23348964
N-(2-ethyl-4-methylphenyl)acetamide
CID 89198969
1,2-diethyl-4-methylbenzene;N-methylethanamine
CID 164855873
N-(2-ethyl-4-methylphenyl)propanamide
CID 90352566
1,2-diethyl-4-methylbenzene;methane
CID 174446118
N-ethyl-2-(ethylamino)-N,5-dimethylbenzamide
CID 62511241
N-(2-ethyl-4-methylphenyl)benzamide
CID 174323635
2-N-ethyl-4-methyl-1-N-(2,2,2-trifluoroethyl)benzene-1,2-diamine
CID 143741349
zinc;2-(ethylamino)-5-methylbenzenediazonium;trichloride
CID 21116290
2-(ethylamino)-5-methylbenzenecarbothioamide
CID 107928326

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-4-methylaniline?
The IUPAC name of N,2-diethyl-4-methylaniline (CID 23348946) is N,2-diethyl-4-methylaniline.
What is the SMILES notation for N,2-diethyl-4-methylaniline?
The canonical SMILES for N,2-diethyl-4-methylaniline is CCNc1ccc(C)cc1CC.
What is the InChIKey of N,2-diethyl-4-methylaniline?
The InChIKey is RJLTZZDHNSWOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-4-10-8-9(3)6-7-11(10)12-5-2/h6-8,12H,4-5H2,1-3H3.
What are the key properties of N,2-diethyl-4-methylaniline?
N,2-diethyl-4-methylaniline has a molecular weight of 163.26 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-4-methylaniline is sourced from PubChem (CID 23348946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).