N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine

C14H26N4O — CID 79661707

IUPACN'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine
SMILESCCCN(CC(C)(C)CN)c1cncc(OCC)n1
InChIInChI=1S/C14H26N4O/c1-5-7-18(11-14(3,4)10-15)12-8-16-9-13(17-12)19-6-2/h8-9H,5-7,10-11,15H2,1-4H3
InChIKeyIGUQTMHTGWGVLI-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.08
Rot. Bonds8

About N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine

N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine (PubChem CID 79661707) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine
PubChem CID79661707
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine
SMILESCCCN(CC(C)(C)CN)c1cncc(OCC)n1
InChIInChI=1S/C14H26N4O/c1-5-7-18(11-14(3,4)10-15)12-8-16-9-13(17-12)19-6-2/h8-9H,5-7,10-11,15H2,1-4H3
InChIKeyIGUQTMHTGWGVLI-UHFFFAOYSA-N
XLogP2.08
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine?
The IUPAC name of N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine (CID 79661707) is N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine.
What is the SMILES notation for N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine?
The canonical SMILES for N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine is CCCN(CC(C)(C)CN)c1cncc(OCC)n1.
What is the InChIKey of N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine?
The InChIKey is IGUQTMHTGWGVLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-5-7-18(11-14(3,4)10-15)12-8-16-9-13(17-12)19-6-2/h8-9H,5-7,10-11,15H2,1-4H3.
What are the key properties of N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine?
N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine has a molecular weight of 266.39 g/mol, XLogP of 2.08, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-ethoxypyrazin-2-yl)-2,2-dimethyl-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 79661707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).