N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine

C12H20N4O — CID 103056756

IUPACN-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine
SMILESCNc1cnc(CN(C)C2CCOC2C)cn1
InChIInChI=1S/C12H20N4O/c1-9-11(4-5-17-9)16(3)8-10-6-15-12(13-2)7-14-10/h6-7,9,11H,4-5,8H2,1-3H3,(H,13,15)
InChIKeyKJDALSCBMHEDOQ-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.13
Rot. Bonds4

About N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine

N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine (PubChem CID 103056756) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine
PubChem CID103056756
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine
SMILESCNc1cnc(CN(C)C2CCOC2C)cn1
InChIInChI=1S/C12H20N4O/c1-9-11(4-5-17-9)16(3)8-10-6-15-12(13-2)7-14-10/h6-7,9,11H,4-5,8H2,1-3H3,(H,13,15)
InChIKeyKJDALSCBMHEDOQ-UHFFFAOYSA-N
XLogP1.13
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine (CID 103056756) is N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine is CNc1cnc(CN(C)C2CCOC2C)cn1.
What is the InChIKey of N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine?
The InChIKey is KJDALSCBMHEDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-11(4-5-17-9)16(3)8-10-6-15-12(13-2)7-14-10/h6-7,9,11H,4-5,8H2,1-3H3,(H,13,15).
What are the key properties of N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine?
N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazin-2-amine is sourced from PubChem (CID 103056756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).