4-ethyl-2,3-dimethylaniline

C10H15N — CID 18695160

IUPAC4-ethyl-2,3-dimethylaniline
SMILESCCc1ccc(N)c(C)c1C
InChIInChI=1S/C10H15N/c1-4-9-5-6-10(11)8(3)7(9)2/h5-6H,4,11H2,1-3H3
InChIKeyBJRWEMVTJBHBFH-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.45
Rot. Bonds1

About 4-ethyl-2,3-dimethylaniline

4-ethyl-2,3-dimethylaniline (PubChem CID 18695160) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 4-ethyl-2,3-dimethylaniline.

Molecular Properties

Compound Name4-ethyl-2,3-dimethylaniline
PubChem CID18695160
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name4-ethyl-2,3-dimethylaniline
SMILESCCc1ccc(N)c(C)c1C
InChIInChI=1S/C10H15N/c1-4-9-5-6-10(11)8(3)7(9)2/h5-6H,4,11H2,1-3H3
InChIKeyBJRWEMVTJBHBFH-UHFFFAOYSA-N
XLogP2.45
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,3-dimethylaniline?
The IUPAC name of 4-ethyl-2,3-dimethylaniline (CID 18695160) is 4-ethyl-2,3-dimethylaniline.
What is the SMILES notation for 4-ethyl-2,3-dimethylaniline?
The canonical SMILES for 4-ethyl-2,3-dimethylaniline is CCc1ccc(N)c(C)c1C.
What is the InChIKey of 4-ethyl-2,3-dimethylaniline?
The InChIKey is BJRWEMVTJBHBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-4-9-5-6-10(11)8(3)7(9)2/h5-6H,4,11H2,1-3H3.
What are the key properties of 4-ethyl-2,3-dimethylaniline?
4-ethyl-2,3-dimethylaniline has a molecular weight of 149.24 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,3-dimethylaniline is sourced from PubChem (CID 18695160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).