ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine

C10H16N2 — CID 143900045

IUPACethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine
SMILESC=C1C=CC=CN1/C=N/C.CC
InChIInChI=1S/C8H10N2.C2H6/c1-8-5-3-4-6-10(8)7-9-2;1-2/h3-7H,1H2,2H3;1-2H3/b9-7+;
InChIKeyUFNBLRYNYDUZBE-BXTVWIJMSA-N
MW164.25 g/mol
LogP2.57
Rot. Bonds1

About ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine

ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine (PubChem CID 143900045) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine.

Molecular Properties

Compound Nameethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine
PubChem CID143900045
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Nameethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine
SMILESC=C1C=CC=CN1/C=N/C.CC
InChIInChI=1S/C8H10N2.C2H6/c1-8-5-3-4-6-10(8)7-9-2;1-2/h3-7H,1H2,2H3;1-2H3/b9-7+;
InChIKeyUFNBLRYNYDUZBE-BXTVWIJMSA-N
XLogP2.57
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

1-Methyl-6-methylidene-1,6-dihydropyrimidine
CID 57831095
Pyrimido[1,6-a]azepine
CID 71346883
2-methyl-3H-imidazo[1,5-a]pyridin-2-ium-3-ide
CID 139179611
N,N'-bis[(e)-(1-pyridyl)methylene]-1,3-propanediamine
CID 171378066
(Phenylazanidylmethylideneamino)methylidenetungsten;propane;vanadium(2+)
CID 20752938
N,N-dimethyl-N'-(phenyliminomethyl)methanimidamide;tungsten(2+)
CID 21019641
8H-pyrido[1,2-c]pyrimidine
CID 22560221
3,6-dimethyl-4H-pyrimidine
CID 53983488
1-Methyl-4-methylidenepyrimidine
CID 57672168
1-Ethyl-4-methylidenepyrimidine
CID 57672220
1-Tert-butyl-4-methylidenepyrimidine
CID 59212616
N-butyl-1-(2H-pyridin-1-yl)methanimine
CID 67807854

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine?
The IUPAC name of ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine (CID 143900045) is ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine.
What is the SMILES notation for ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine?
The canonical SMILES for ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine is C=C1C=CC=CN1/C=N/C.CC.
What is the InChIKey of ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine?
The InChIKey is UFNBLRYNYDUZBE-BXTVWIJMSA-N. The full InChI is InChI=1S/C8H10N2.C2H6/c1-8-5-3-4-6-10(8)7-9-2;1-2/h3-7H,1H2,2H3;1-2H3/b9-7+;.
What are the key properties of ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine?
ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine has a molecular weight of 164.25 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-1-(2-methylidene-1-pyridinyl)methanimine is sourced from PubChem (CID 143900045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).