3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine

C11H12N2 — CID 16741623

IUPAC3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine
SMILESCC/C=C/c1cnc2ccccn12
InChIInChI=1S/C11H12N2/c1-2-3-6-10-9-12-11-7-4-5-8-13(10)11/h3-9H,2H2,1H3/b6-3+
InChIKeyYECFTXDCEZJBQY-ZZXKWVIFSA-N
MW172.23 g/mol
LogP2.76
Rot. Bonds2

About 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine

3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine (PubChem CID 16741623) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine
PubChem CID16741623
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine
SMILESCC/C=C/c1cnc2ccccn12
InChIInChI=1S/C11H12N2/c1-2-3-6-10-9-12-11-7-4-5-8-13(10)11/h3-9H,2H2,1H3/b6-3+
InChIKeyYECFTXDCEZJBQY-ZZXKWVIFSA-N
XLogP2.76
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(E)-3-phenylprop-1-enyl]imidazo[1,2-a]pyridine
CID 16741715
N-(4-imidazo[1,2-a]pyridin-3-ylbut-3-enyl)acetamide
CID 170488809
S-(4-imidazo[1,2-a]pyridin-3-ylbut-3-enyl) ethanethioate
CID 170480250
3-imidazo[1,2-a]pyrazin-3-ylprop-2-en-1-amine
CID 169463701
6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid
CID 126768438
3-(2-methylpentan-2-yl)imidazo[1,2-a]pyridine
CID 135275036
(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one
CID 10805494
imidazo[1,2-a]pyridin-3-ylmethyl(trimethyl)azanium iodide
CID 14602276
1-imidazo[1,2-a]pyridin-3-yl-N-methylmethanamine;hydrate;dihydrochloride
CID 73012288
imidazo[1,2-a]pyridin-3-ylmethanol;hydrochloride
CID 22938849
1-ethyl-3-[(E)-imidazo[1,2-a]pyridin-3-ylmethylideneamino]oxypyrrolidin-2-one
CID 167943124
2-imidazo[1,2-a]pyridin-3-yl-N-methylethanamine
CID 82598866

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine (CID 16741623) is 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine is CC/C=C/c1cnc2ccccn12.
What is the InChIKey of 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine?
The InChIKey is YECFTXDCEZJBQY-ZZXKWVIFSA-N. The full InChI is InChI=1S/C11H12N2/c1-2-3-6-10-9-12-11-7-4-5-8-13(10)11/h3-9H,2H2,1H3/b6-3+.
What are the key properties of 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine?
3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine has a molecular weight of 172.23 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 16741623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).