N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine

C13H22N4O — CID 66465463

IUPACN-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine
SMILESCNCc1cncc(OCC2CCCCN2C)n1
InChIInChI=1S/C13H22N4O/c1-14-7-11-8-15-9-13(16-11)18-10-12-5-3-4-6-17(12)2/h8-9,12,14H,3-7,10H2,1-2H3
InChIKeyZTWJCZGNCRDOOL-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.06
Rot. Bonds5

About N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine

N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine (PubChem CID 66465463) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine
PubChem CID66465463
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine
SMILESCNCc1cncc(OCC2CCCCN2C)n1
InChIInChI=1S/C13H22N4O/c1-14-7-11-8-15-9-13(16-11)18-10-12-5-3-4-6-17(12)2/h8-9,12,14H,3-7,10H2,1-2H3
InChIKeyZTWJCZGNCRDOOL-UHFFFAOYSA-N
XLogP1.06
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine (CID 66465463) is N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine is CNCc1cncc(OCC2CCCCN2C)n1.
What is the InChIKey of N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine?
The InChIKey is ZTWJCZGNCRDOOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-14-7-11-8-15-9-13(16-11)18-10-12-5-3-4-6-17(12)2/h8-9,12,14H,3-7,10H2,1-2H3.
What are the key properties of N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine?
N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine has a molecular weight of 250.35 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine is sourced from PubChem (CID 66465463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).