ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine

C14H28N2 — CID 142392708

IUPACethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine
SMILESCC.CC.CC.[H]/N=C/N1C=CC(C)=CC1=C
InChIInChI=1S/C8H10N2.3C2H6/c1-7-3-4-10(6-9)8(2)5-7;3*1-2/h3-6,9H,2H2,1H3;3*1-2H3/b9-6+;;;
InChIKeyMSYANJLPARISLN-HCRDSFAKSA-N
MW224.39 g/mol
LogP4.96
Rot. Bonds1

About ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine

ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine (PubChem CID 142392708) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine.

Molecular Properties

Compound Nameethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine
PubChem CID142392708
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Nameethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine
SMILESCC.CC.CC.[H]/N=C/N1C=CC(C)=CC1=C
InChIInChI=1S/C8H10N2.3C2H6/c1-7-3-4-10(6-9)8(2)5-7;3*1-2/h3-6,9H,2H2,1H3;3*1-2H3/b9-6+;;;
InChIKeyMSYANJLPARISLN-HCRDSFAKSA-N
XLogP4.96
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 54.96
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

N-ethyl-N-octa-1,3,6-trien-2-ylmethanimidamide
CID 123701301
6-[(1Z)-buta-1,3-dienyl]-5-methyl-1-[(Z)-prop-1-enyl]pyridin-2-imine
CID 132099128
[5-(2-Methylbutan-2-yl)-2-methylidene-1-pyridinyl]methanimine
CID 142376774
ethane;N-methyl-N-[(3Z)-4-methylhexa-1,3,5-trien-2-yl]methanimidamide
CID 142392847
1-[(E)-but-2-en-2-yl]-5-methylpyridin-2-imine;ethane
CID 143424286
Ethane;(2-methylidene-1-pyridinyl)methanimine
CID 144750419
N',4-dimethyl-2-methylidenepyridine-1-carboximidamide;ethane
CID 145222589
(5-Methyl-2-methylidene-1-pyridinyl)methanimine
CID 155372104
(2-Imino-1-prop-1-en-2-yl-4-pyridinyl)methanamine
CID 166139731
N,N-diethyl-3-(1-methanimidoyl-2-methylidene-4-pyridinyl)prop-2-yn-1-amine
CID 169842862
[(2E)-2-butylidene-1-pyridinyl]methanimine
CID 174321614
Ethane;1-ethanimidoyl-4-methylpyridin-2-imine
CID 176567172

Frequently Asked Questions

What is the IUPAC name of ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine?
The IUPAC name of ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine (CID 142392708) is ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine.
What is the SMILES notation for ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine?
The canonical SMILES for ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine is CC.CC.CC.[H]/N=C/N1C=CC(C)=CC1=C.
What is the InChIKey of ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine?
The InChIKey is MSYANJLPARISLN-HCRDSFAKSA-N. The full InChI is InChI=1S/C8H10N2.3C2H6/c1-7-3-4-10(6-9)8(2)5-7;3*1-2/h3-6,9H,2H2,1H3;3*1-2H3/b9-6+;;;.
What are the key properties of ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine?
ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine has a molecular weight of 224.39 g/mol, XLogP of 4.96, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4-methyl-2-methylidene-1-pyridinyl)methanimine is sourced from PubChem (CID 142392708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).