3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine

C12H22N4O — CID 65192090

IUPAC3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
SMILESCC(C)Oc1cncc(NC(CN)C(C)C)n1
InChIInChI=1S/C12H22N4O/c1-8(2)10(5-13)15-11-6-14-7-12(16-11)17-9(3)4/h6-10H,5,13H2,1-4H3,(H,15,16)
InChIKeyBUHIQWDSULODST-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.66
Rot. Bonds6

About 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine

3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine (PubChem CID 65192090) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine.

Molecular Properties

Compound Name3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
PubChem CID65192090
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
SMILESCC(C)Oc1cncc(NC(CN)C(C)C)n1
InChIInChI=1S/C12H22N4O/c1-8(2)10(5-13)15-11-6-14-7-12(16-11)17-9(3)4/h6-10H,5,13H2,1-4H3,(H,15,16)
InChIKeyBUHIQWDSULODST-UHFFFAOYSA-N
XLogP1.66
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-2-N-(6-propan-2-yloxypyrazin-2-yl)propane-1,2-diamine
CID 114154990
2-N-(6-chloropyrazin-2-yl)-3-methylbutane-1,2-diamine
CID 116650856
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-methyl-2-[[(6-propan-2-yloxypyrazin-2-yl)amino]methyl]butanoic acid
CID 65226992
3-methyl-4-[(6-propan-2-yloxypyrazin-2-yl)amino]butan-1-ol
CID 133484788
2-(furan-2-yl)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]ethanol
CID 133484826
4-methoxy-1-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,3-diamine
CID 106244415
ethane;2-methyl-N-(6-propan-2-yloxypyrazin-2-yl)propanamide
CID 145083687
N-(2-chloro-3-methoxypropyl)-6-propan-2-yloxypyrazin-2-amine
CID 65027123
2-methyl-3-N-(6-propoxypyrazin-2-yl)butane-1,3-diamine
CID 113485176
3-methoxy-2-N-(6-methoxypyrazin-2-yl)propane-1,2-diamine
CID 106181983

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine?
The IUPAC name of 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine (CID 65192090) is 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine.
What is the SMILES notation for 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine?
The canonical SMILES for 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine is CC(C)Oc1cncc(NC(CN)C(C)C)n1.
What is the InChIKey of 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine?
The InChIKey is BUHIQWDSULODST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-8(2)10(5-13)15-11-6-14-7-12(16-11)17-9(3)4/h6-10H,5,13H2,1-4H3,(H,15,16).
What are the key properties of 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine?
3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine has a molecular weight of 238.33 g/mol, XLogP of 1.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine is sourced from PubChem (CID 65192090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).