N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine

C7H13N3 — CID 143325168

IUPACN-methyl-1-(2-methylidenepiperazin-1-yl)methanimine
SMILESC=C1CNCCN1/C=N/C
InChIInChI=1S/C7H13N3/c1-7-5-9-3-4-10(7)6-8-2/h6,9H,1,3-5H2,2H3/b8-6+
InChIKeyCHHUZTDBZSIDMP-SOFGYWHQSA-N
MW139.20 g/mol
LogP0.06
Rot. Bonds1

About N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine

N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine (PubChem CID 143325168) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine.

Molecular Properties

Compound NameN-methyl-1-(2-methylidenepiperazin-1-yl)methanimine
PubChem CID143325168
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC NameN-methyl-1-(2-methylidenepiperazin-1-yl)methanimine
SMILESC=C1CNCCN1/C=N/C
InChIInChI=1S/C7H13N3/c1-7-5-9-3-4-10(7)6-8-2/h6,9H,1,3-5H2,2H3/b8-6+
InChIKeyCHHUZTDBZSIDMP-SOFGYWHQSA-N
XLogP0.06
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-ethenyl-N-methylpiperazin-2-imine
CID 145392859
1-methyl-2-methylidene-1,4-diazepane
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1-prop-1-enylpiperazin-2-one
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5-methylidene-1-prop-1-enylimidazolidine
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N-methyl-N-[(Z)-(1-methylpiperazin-2-ylidene)amino]ethenamine
CID 154667163
1-methanimidoylpiperazin-2-imine;molecular hydrogen
CID 142599598
2-methylidene-5,6,7,8-tetrahydro-3H-imidazo[1,2-a]pyrazine
CID 91509600
[(1S)-2,2,2-trifluoro-1-(2-methylidenepiperazin-1-yl)ethyl]hydrazine
CID 90248970
1-(methylideneamino)-N-(2-methylpropyl)piperazin-2-imine
CID 170084368
(2Z,4E)-N-methyl-2-(piperazin-1-ylmethyl)hexa-2,4-dien-1-imine
CID 145197990
(3E)-3-ethylidene-4-methylidenepyrrolidine
CID 170150299
(3Z)-3-ethylidene-N-methylpiperidin-4-imine
CID 143890086

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine?
The IUPAC name of N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine (CID 143325168) is N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine.
What is the SMILES notation for N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine?
The canonical SMILES for N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine is C=C1CNCCN1/C=N/C.
What is the InChIKey of N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine?
The InChIKey is CHHUZTDBZSIDMP-SOFGYWHQSA-N. The full InChI is InChI=1S/C7H13N3/c1-7-5-9-3-4-10(7)6-8-2/h6,9H,1,3-5H2,2H3/b8-6+.
What are the key properties of N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine?
N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine has a molecular weight of 139.20 g/mol, XLogP of 0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylidenepiperazin-1-yl)methanimine is sourced from PubChem (CID 143325168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).