N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine

C14H20N4 — CID 62585650

IUPACN'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine
SMILESCC(C)CN(CCN)c1cnc2ccccc2n1
InChIInChI=1S/C14H20N4/c1-11(2)10-18(8-7-15)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11H,7-8,10,15H2,1-2H3
InChIKeyLJQDIRVWRYQZSA-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.05
Rot. Bonds5

About N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine

N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine (PubChem CID 62585650) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine
PubChem CID62585650
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine
SMILESCC(C)CN(CCN)c1cnc2ccccc2n1
InChIInChI=1S/C14H20N4/c1-11(2)10-18(8-7-15)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11H,7-8,10,15H2,1-2H3
InChIKeyLJQDIRVWRYQZSA-UHFFFAOYSA-N
XLogP2.05
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine?
The IUPAC name of N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine (CID 62585650) is N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine?
The canonical SMILES for N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine is CC(C)CN(CCN)c1cnc2ccccc2n1.
What is the InChIKey of N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine?
The InChIKey is LJQDIRVWRYQZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-11(2)10-18(8-7-15)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11H,7-8,10,15H2,1-2H3.
What are the key properties of N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine?
N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine has a molecular weight of 244.34 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylpropyl)-N'-quinoxalin-2-ylethane-1,2-diamine is sourced from PubChem (CID 62585650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).