N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine

C11H22N4O — CID 162358384

IUPACN-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine
SMILESC/N=C(\N1CCOCC1)N1CCN(C)CC1
InChIInChI=1S/C11H22N4O/c1-12-11(15-7-9-16-10-8-15)14-5-3-13(2)4-6-14/h3-10H2,1-2H3/b12-11-
InChIKeyMXNZWHQGJIWTER-QXMHVHEDSA-N
MW226.32 g/mol
LogP-0.45
Rot. Bonds

About N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine

N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine (PubChem CID 162358384) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine.

Molecular Properties

Compound NameN-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine
PubChem CID162358384
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC NameN-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine
SMILESC/N=C(\N1CCOCC1)N1CCN(C)CC1
InChIInChI=1S/C11H22N4O/c1-12-11(15-7-9-16-10-8-15)14-5-3-13(2)4-6-14/h3-10H2,1-2H3/b12-11-
InChIKeyMXNZWHQGJIWTER-QXMHVHEDSA-N
XLogP-0.45
TPSA31.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine?
The IUPAC name of N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine (CID 162358384) is N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine.
What is the SMILES notation for N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine?
The canonical SMILES for N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine is C/N=C(\N1CCOCC1)N1CCN(C)CC1.
What is the InChIKey of N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine?
The InChIKey is MXNZWHQGJIWTER-QXMHVHEDSA-N. The full InChI is InChI=1S/C11H22N4O/c1-12-11(15-7-9-16-10-8-15)14-5-3-13(2)4-6-14/h3-10H2,1-2H3/b12-11-.
What are the key properties of N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine?
N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine has a molecular weight of 226.32 g/mol, XLogP of -0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylpiperazin-1-yl)-1-morpholin-4-ylmethanimine is sourced from PubChem (CID 162358384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).