(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine

C10H12BrN — CID 142503221

IUPAC(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine
SMILESC=CN1C=C(Br)C=C/C1=C/CC
InChIInChI=1S/C10H12BrN/c1-3-5-10-7-6-9(11)8-12(10)4-2/h4-8H,2-3H2,1H3/b10-5-
InChIKeyQEHNXMJVGNROJT-YHYXMXQVSA-N
MW226.12 g/mol
LogP3.53
Rot. Bonds2

About (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine

(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine (PubChem CID 142503221) has the molecular formula C10H12BrN and a molecular weight of 226.12 g/mol. Its IUPAC name is (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine.

Molecular Properties

Compound Name(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine
PubChem CID142503221
Molecular FormulaC10H12BrN
Molecular Weight226.12 g/mol
Exact Mass225.02
IUPAC Name(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine
SMILESC=CN1C=C(Br)C=C/C1=C/CC
InChIInChI=1S/C10H12BrN/c1-3-5-10-7-6-9(11)8-12(10)4-2/h4-8H,2-3H2,1H3/b10-5-
InChIKeyQEHNXMJVGNROJT-YHYXMXQVSA-N
XLogP3.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.12
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Methyl-2-vinylpyridine
CID 19781255
1-ethenyl-2-methyl-2H-pyridine
CID 20349472
1,5-Dimethyl-2-methylidenepyridine
CID 20671513
3,5-Dibromo-2-cyclopropylidene-1-methylpyridine
CID 66612817
5-bromo-1,2-dimethyl-2H-pyridine
CID 68435770
(2Z)-2-[(Z)-1-bromobut-2-enylidene]-3-methylidene-1-prop-2-enylpyrrole
CID 88866359
(2Z)-1,5-dimethyl-2-propylidenepyridine
CID 89038790
2-methylidene-1-[(Z)-pent-2-en-3-yl]pyridine
CID 89305358
1-methyl-7-methylidene-4H-azepine
CID 90791106
2-(5-bromo-2-methyl-2H-pyridin-1-yl)acetonitrile
CID 117655226
(2Z)-5-bromo-2-[(E)-hex-2-enylidene]-1H-pyridine
CID 118889031
5-(Bromomethyl)-1-methyl-2-methylidenepyridine
CID 123372442

Frequently Asked Questions

What is the IUPAC name of (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine?
The IUPAC name of (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine (CID 142503221) is (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine.
What is the SMILES notation for (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine?
The canonical SMILES for (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine is C=CN1C=C(Br)C=C/C1=C/CC.
What is the InChIKey of (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine?
The InChIKey is QEHNXMJVGNROJT-YHYXMXQVSA-N. The full InChI is InChI=1S/C10H12BrN/c1-3-5-10-7-6-9(11)8-12(10)4-2/h4-8H,2-3H2,1H3/b10-5-.
What are the key properties of (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine?
(2Z)-5-bromo-1-ethenyl-2-propylidenepyridine has a molecular weight of 226.12 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-5-bromo-1-ethenyl-2-propylidenepyridine is sourced from PubChem (CID 142503221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).