1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane

C12H18N2 — CID 178116820

IUPAC1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane
SMILESC=Cc1cccnc1/C=N/C.CCC
InChIInChI=1S/C9H10N2.C3H8/c1-3-8-5-4-6-11-9(8)7-10-2;1-3-2/h3-7H,1H2,2H3;3H2,1-2H3/b10-7+;
InChIKeyAHSCWRHOGGMXAL-HCUGZAAXSA-N
MW190.29 g/mol
LogP3.19
Rot. Bonds2

About 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane

1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane (PubChem CID 178116820) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane.

Molecular Properties

Compound Name1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane
PubChem CID178116820
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane
SMILESC=Cc1cccnc1/C=N/C.CCC
InChIInChI=1S/C9H10N2.C3H8/c1-3-8-5-4-6-11-9(8)7-10-2;1-3-2/h3-7H,1H2,2H3;3H2,1-2H3/b10-7+;
InChIKeyAHSCWRHOGGMXAL-HCUGZAAXSA-N
XLogP3.19
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(methyliminomethyl)pyridin-3-ol
CID 136948272
(Z)-N-(3-ethenyl-2-pyridinyl)propan-1-imine
CID 178088969
3-(3-ethenyl-2-pyridinyl)prop-2-enenitrile
CID 57081275
6-ethenyl-5-ethylquinoline
CID 166703553
2-ethenyl-3-(2-methylpentan-2-yl)pyridine
CID 130178761
ethane;3-ethenyl-2-methylsulfanylpyridine
CID 157029026
but-1-ene;3-ethenyl-N-methylpyridin-2-amine;prop-2-ene-1-thiol
CID 142838359
2-[(E)-ethoxyiminomethyl]pyridin-3-ol
CID 137274276
(1S)-1-(2-ethenyl-3-pyridinyl)propan-1-amine
CID 74788873
1-(6-ethenylquinoxalin-5-yl)-N-methylmethanimine
CID 126651808
2-(2-ethenyl-6-methylphenyl)-3-methylpyridine
CID 68936277
(3-ethenyl-2-pyridinyl)-oxidoazanium
CID 22328570

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane?
The IUPAC name of 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane (CID 178116820) is 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane.
What is the SMILES notation for 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane?
The canonical SMILES for 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane is C=Cc1cccnc1/C=N/C.CCC.
What is the InChIKey of 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane?
The InChIKey is AHSCWRHOGGMXAL-HCUGZAAXSA-N. The full InChI is InChI=1S/C9H10N2.C3H8/c1-3-8-5-4-6-11-9(8)7-10-2;1-3-2/h3-7H,1H2,2H3;3H2,1-2H3/b10-7+;.
What are the key properties of 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane?
1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane has a molecular weight of 190.29 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane is sourced from PubChem (CID 178116820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).