3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine

C11H20N4O2 — CID 114154990

IUPAC3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine
SMILESCOCC(CN)Nc1cncc(OC(C)C)n1
InChIInChI=1S/C11H20N4O2/c1-8(2)17-11-6-13-5-10(15-11)14-9(4-12)7-16-3/h5-6,8-9H,4,7,12H2,1-3H3,(H,14,15)
InChIKeyLKMPHSGSGOJCIE-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.65
Rot. Bonds7

About 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine

3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine (PubChem CID 114154990) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine.

Molecular Properties

Compound Name3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine
PubChem CID114154990
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine
SMILESCOCC(CN)Nc1cncc(OC(C)C)n1
InChIInChI=1S/C11H20N4O2/c1-8(2)17-11-6-13-5-10(15-11)14-9(4-12)7-16-3/h5-6,8-9H,4,7,12H2,1-3H3,(H,14,15)
InChIKeyLKMPHSGSGOJCIE-UHFFFAOYSA-N
XLogP0.65
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-methoxy-2-N-(6-methoxypyrazin-2-yl)propane-1,2-diamine
CID 106181983
2-N-(6-ethoxypyrazin-2-yl)-3-methoxypropane-1,2-diamine
CID 106182379
3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
CID 65192090
4-methoxy-1-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,3-diamine
CID 106244415
N-(2-chloro-3-methoxypropyl)-6-propan-2-yloxypyrazin-2-amine
CID 65027123
4-methoxy-3-N-(6-propoxypyrazin-2-yl)butane-1,3-diamine
CID 114151042
3-methoxy-2-N-(6-methoxy-2-pyridinyl)propane-1,2-diamine
CID 106181643
3-methoxy-2-N-(5-methylpyridazin-3-yl)propane-1,2-diamine
CID 106182176
2,4-dimethyl-2-N-(6-propan-2-yloxypyrazin-2-yl)pentane-1,2-diamine
CID 115310276
2-ethyl-1-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
CID 115306323
3-methoxy-2-N-pyridin-4-ylpropane-1,2-diamine
CID 106182027
2-methyl-3-N-(6-propoxypyrazin-2-yl)butane-1,3-diamine
CID 113485176

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine?
The IUPAC name of 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine (CID 114154990) is 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine.
What is the SMILES notation for 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine?
The canonical SMILES for 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine is COCC(CN)Nc1cncc(OC(C)C)n1.
What is the InChIKey of 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine?
The InChIKey is LKMPHSGSGOJCIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-8(2)17-11-6-13-5-10(15-11)14-9(4-12)7-16-3/h5-6,8-9H,4,7,12H2,1-3H3,(H,14,15).
What are the key properties of 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine?
3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine has a molecular weight of 240.31 g/mol, XLogP of 0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine is sourced from PubChem (CID 114154990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).