4-ethoxy-N,N-dimethylaniline

C10H15NO — CID 3624890

IUPAC4-ethoxy-N,N-dimethylaniline
SMILESCCOc1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-4-12-10-7-5-9(6-8-10)11(2)3/h5-8H,4H2,1-3H3
InChIKeyNOTZHLDTUSLGBM-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.15
Rot. Bonds3

About 4-ethoxy-N,N-dimethylaniline

4-ethoxy-N,N-dimethylaniline (PubChem CID 3624890) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-ethoxy-N,N-dimethylaniline.

Molecular Properties

Compound Name4-ethoxy-N,N-dimethylaniline
PubChem CID3624890
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name4-ethoxy-N,N-dimethylaniline
SMILESCCOc1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-4-12-10-7-5-9(6-8-10)11(2)3/h5-8H,4H2,1-3H3
InChIKeyNOTZHLDTUSLGBM-UHFFFAOYSA-N
XLogP2.15
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-[2-(4-ethoxyphenyl)ethenyl]-N,N-dimethylaniline
CID 67837040
N-(4-ethoxyphenyl)-N,4-dimethylaniline
CID 20575987
6-N-[4-(dimethylamino)phenyl]-4-N-(4-ethoxyphenyl)pyrimidine-4,6-diamine
CID 112866338
4-[5-[4-(dimethylamino)phenoxy]pentoxy]-N,N-dimethylaniline;dihydrochloride
CID 135564251
4-ethoxy-N-(4-ethoxyphenyl)-N-phenylaniline
CID 18996804
(4-ethoxyphenyl)-methylcyanamide
CID 117029387
4-hexoxy-N,N-dimethylaniline
CID 19782341
5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
CID 167873976
3-[4-(dimethylamino)phenyl]-1-(4-ethoxyphenyl)prop-2-en-1-one
CID 2880876
4-(4-ethoxy-N-methylanilino)benzaldehyde
CID 12657169
4-[(E)-2-(4-ethoxyphenyl)ethenyl]-N,N-bis[4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenyl]aniline
CID 122211085
N-[4-(dimethylamino)phenyl]-2-(4-ethoxyphenoxy)propanamide
CID 53267102

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N,N-dimethylaniline?
The IUPAC name of 4-ethoxy-N,N-dimethylaniline (CID 3624890) is 4-ethoxy-N,N-dimethylaniline.
What is the SMILES notation for 4-ethoxy-N,N-dimethylaniline?
The canonical SMILES for 4-ethoxy-N,N-dimethylaniline is CCOc1ccc(N(C)C)cc1.
What is the InChIKey of 4-ethoxy-N,N-dimethylaniline?
The InChIKey is NOTZHLDTUSLGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-12-10-7-5-9(6-8-10)11(2)3/h5-8H,4H2,1-3H3.
What are the key properties of 4-ethoxy-N,N-dimethylaniline?
4-ethoxy-N,N-dimethylaniline has a molecular weight of 165.24 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N,N-dimethylaniline is sourced from PubChem (CID 3624890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).