3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline

C18H24N2O — CID 60935217

IUPAC3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline
SMILESCCOc1cccc(NC(C)c2c(C)cc(C)nc2C)c1
InChIInChI=1S/C18H24N2O/c1-6-21-17-9-7-8-16(11-17)20-15(5)18-12(2)10-13(3)19-14(18)4/h7-11,15,20H,6H2,1-5H3
InChIKeyJRJDBUZUOQVUDA-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.58
Rot. Bonds5

About 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline

3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline (PubChem CID 60935217) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline.

Molecular Properties

Compound Name3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline
PubChem CID60935217
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline
SMILESCCOc1cccc(NC(C)c2c(C)cc(C)nc2C)c1
InChIInChI=1S/C18H24N2O/c1-6-21-17-9-7-8-16(11-17)20-15(5)18-12(2)10-13(3)19-14(18)4/h7-11,15,20H,6H2,1-5H3
InChIKeyJRJDBUZUOQVUDA-UHFFFAOYSA-N
XLogP4.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(2,4,6-trimethyl-3-pyridinyl)ethylamino]phenol
CID 43771050
3-ethoxy-N-[1-(3-methylthiophen-2-yl)ethyl]aniline
CID 63993267
N-[1-(2-chlorophenyl)ethyl]-3-ethoxyaniline
CID 54864881
2-[1-(3-ethoxyanilino)ethyl]phenol
CID 54865033
3-ethoxy-N-[(2R)-pentan-2-yl]aniline
CID 93363089
3,5-difluoro-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline
CID 43765047
N-[1-[4-(dimethylamino)phenyl]ethyl]-3-ethoxyaniline
CID 60935970
3-ethoxy-N-(3-methoxybutan-2-yl)aniline
CID 115917474
3-methoxy-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
CID 43106119
2,3-dichloro-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline
CID 43772215
N-[1-(2-methylphenyl)ethyl]-3-(2-methylpropoxy)aniline
CID 63449937
N-tert-butyl-3-ethoxyaniline
CID 58745523

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline?
The IUPAC name of 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline (CID 60935217) is 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline.
What is the SMILES notation for 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline?
The canonical SMILES for 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline is CCOc1cccc(NC(C)c2c(C)cc(C)nc2C)c1.
What is the InChIKey of 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline?
The InChIKey is JRJDBUZUOQVUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-6-21-17-9-7-8-16(11-17)20-15(5)18-12(2)10-13(3)19-14(18)4/h7-11,15,20H,6H2,1-5H3.
What are the key properties of 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline?
3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline has a molecular weight of 284.40 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]aniline is sourced from PubChem (CID 60935217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).