3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine

C14H20N4O — CID 102987053

IUPAC3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine
SMILESCOCCN(c1nc2ccccc2nc1N)C(C)C
InChIInChI=1S/C14H20N4O/c1-10(2)18(8-9-19-3)14-13(15)16-11-6-4-5-7-12(11)17-14/h4-7,10H,8-9H2,1-3H3,(H2,15,16)
InChIKeyQZAIBSCLDLOXFQ-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.07
Rot. Bonds5

About 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine

3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine (PubChem CID 102987053) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine.

Molecular Properties

Compound Name3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine
PubChem CID102987053
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine
SMILESCOCCN(c1nc2ccccc2nc1N)C(C)C
InChIInChI=1S/C14H20N4O/c1-10(2)18(8-9-19-3)14-13(15)16-11-6-4-5-7-12(11)17-14/h4-7,10H,8-9H2,1-3H3,(H2,15,16)
InChIKeyQZAIBSCLDLOXFQ-UHFFFAOYSA-N
XLogP2.07
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-N,3-N-bis(2-methoxyethyl)quinoxaline-2,3-diamine
CID 102986130
[2-[2-methoxyethyl(propan-2-yl)amino]quinolin-3-yl]methanol
CID 82951995
3-(bromomethyl)-N-(2-methoxyethyl)-N-propan-2-ylimidazo[1,2-a]pyridin-2-amine
CID 107084898
5-chloro-2-N-(2-methoxyethyl)-2-N-propan-2-ylpyridine-2,3-diamine
CID 82949133
3-[[butan-2-yl(2-methoxyethyl)amino]methyl]quinolin-2-amine
CID 62209123
3-N-methyl-3-N-propylquinoxaline-2,3-diamine
CID 102985418
3-(2-aminoethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 114057477
2-[2-methoxyethyl(propan-2-yl)amino]pyridine-3-carbothioamide
CID 82951921
4-(aminomethyl)-3-chloro-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 107055721
3-N-(2-methoxyethyl)quinoxaline-2,3-diamine
CID 102983552
4-N-(2-methoxyethyl)-4-N-(1-methoxypropan-2-yl)quinoline-3,4-diamine
CID 103963108
2-[2-methoxyethyl(propan-2-yl)amino]pyridine-3-carboxylic acid
CID 82952199

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine?
The IUPAC name of 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine (CID 102987053) is 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine.
What is the SMILES notation for 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine?
The canonical SMILES for 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine is COCCN(c1nc2ccccc2nc1N)C(C)C.
What is the InChIKey of 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine?
The InChIKey is QZAIBSCLDLOXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-10(2)18(8-9-19-3)14-13(15)16-11-6-4-5-7-12(11)17-14/h4-7,10H,8-9H2,1-3H3,(H2,15,16).
What are the key properties of 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine?
3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine has a molecular weight of 260.34 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methoxyethyl)-3-N-propan-2-ylquinoxaline-2,3-diamine is sourced from PubChem (CID 102987053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).