5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine

C12H20N2O — CID 167873976

IUPAC5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
SMILESCCOc1cc(N(C)C)cc(N(C)C)c1
InChIInChI=1S/C12H20N2O/c1-6-15-12-8-10(13(2)3)7-11(9-12)14(4)5/h7-9H,6H2,1-5H3
InChIKeyNYWRVVAJCGWZHH-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.22
Rot. Bonds4

About 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine

5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine (PubChem CID 167873976) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine.

Molecular Properties

Compound Name5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
PubChem CID167873976
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
SMILESCCOc1cc(N(C)C)cc(N(C)C)c1
InChIInChI=1S/C12H20N2O/c1-6-15-12-8-10(13(2)3)7-11(9-12)14(4)5/h7-9H,6H2,1-5H3
InChIKeyNYWRVVAJCGWZHH-UHFFFAOYSA-N
XLogP2.22
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The IUPAC name of 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine (CID 167873976) is 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine.
What is the SMILES notation for 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The canonical SMILES for 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine is CCOc1cc(N(C)C)cc(N(C)C)c1.
What is the InChIKey of 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
The InChIKey is NYWRVVAJCGWZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-6-15-12-8-10(13(2)3)7-11(9-12)14(4)5/h7-9H,6H2,1-5H3.
What are the key properties of 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine?
5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine has a molecular weight of 208.30 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine is sourced from PubChem (CID 167873976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).