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

C9H14N2 — CID 144750419

IUPACethane;(2-methylidene-1-pyridinyl)methanimine
SMILESCC.[H]/N=C/N1C=CC=CC1=C
InChIInChI=1S/C7H8N2.C2H6/c1-7-4-2-3-5-9(7)6-8;1-2/h2-6,8H,1H2;1-2H3/b8-6+;
InChIKeyVYINVGGTSOMSKD-WVLIHFOGSA-N
MW150.22 g/mol
LogP2.52
Rot. Bonds1

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

ethane;(2-methylidene-1-pyridinyl)methanimine (PubChem CID 144750419) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is ethane;(2-methylidene-1-pyridinyl)methanimine.

Molecular Properties

Compound Nameethane;(2-methylidene-1-pyridinyl)methanimine
PubChem CID144750419
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Nameethane;(2-methylidene-1-pyridinyl)methanimine
SMILESCC.[H]/N=C/N1C=CC=CC1=C
InChIInChI=1S/C7H8N2.C2H6/c1-7-4-2-3-5-9(7)6-8;1-2/h2-6,8H,1H2;1-2H3/b8-6+;
InChIKeyVYINVGGTSOMSKD-WVLIHFOGSA-N
XLogP2.52
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.52
H-Bond Donors ≤ 51
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

Pyrimido[1,6-a]azepine
CID 71346883
1-[(1Z,3E)-4-[carbamimidoyl(methyl)amino]penta-1,3-dienyl]-1-[(2E)-penta-2,4-dien-2-yl]guanidine
CID 88552805
N-methyl-1-(2-methylidene-1-pyridinyl)methanimine
CID 89288883
[(2Z)-2-(iodomethylidene)-1-pyridinyl]methanimine
CID 89777913
N-[(Z)-but-2-enyl]-N-[(Z)-prop-1-enyl]methanimidamide
CID 90443484
Pyrido[1,2-c][1,3]diazepine
CID 117656110
1-methanimidoyl-6-methyl-2H-pyridin-2-amine
CID 117705196
N-butan-2-yl-1-(2-methylidene-1-pyridinyl)methanimine
CID 123279872
1-Prop-1-en-2-ylpyridin-2-imine
CID 123881417
1-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]pyridin-2-imine
CID 130307955
1-[(3E,5Z)-hepta-1,3,5-trien-4-yl]pyridin-2-imine
CID 130307956
(6Z)-6-ethylidene-1-methylpyrimidine
CID 135253879

Frequently Asked Questions

What is the IUPAC name of ethane;(2-methylidene-1-pyridinyl)methanimine?
The IUPAC name of ethane;(2-methylidene-1-pyridinyl)methanimine (CID 144750419) is ethane;(2-methylidene-1-pyridinyl)methanimine.
What is the SMILES notation for ethane;(2-methylidene-1-pyridinyl)methanimine?
The canonical SMILES for ethane;(2-methylidene-1-pyridinyl)methanimine is CC.[H]/N=C/N1C=CC=CC1=C.
What is the InChIKey of ethane;(2-methylidene-1-pyridinyl)methanimine?
The InChIKey is VYINVGGTSOMSKD-WVLIHFOGSA-N. The full InChI is InChI=1S/C7H8N2.C2H6/c1-7-4-2-3-5-9(7)6-8;1-2/h2-6,8H,1H2;1-2H3/b8-6+;.
What are the key properties of ethane;(2-methylidene-1-pyridinyl)methanimine?
ethane;(2-methylidene-1-pyridinyl)methanimine has a molecular weight of 150.22 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2-methylidene-1-pyridinyl)methanimine is sourced from PubChem (CID 144750419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).