ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate

C19H20N4O2 — CID 156708813

IUPACethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate
SMILESC/C=C(\c1cc(C(=O)OCC)[nH]n1)c1cn2cc(C3CC3)ccc2n1
InChIInChI=1S/C19H20N4O2/c1-3-14(15-9-16(22-21-15)19(24)25-4-2)17-11-23-10-13(12-5-6-12)7-8-18(23)20-17/h3,7-12H,4-6H2,1-2H3,(H,21,22)/b14-3+
InChIKeyILCMZSWAQBTSDB-LZWSPWQCSA-N
MW336.40 g/mol
LogP3.56
Rot. Bonds5

About ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate

ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate (PubChem CID 156708813) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate.

Molecular Properties

Compound Nameethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate
PubChem CID156708813
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Nameethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate
SMILESC/C=C(\c1cc(C(=O)OCC)[nH]n1)c1cn2cc(C3CC3)ccc2n1
InChIInChI=1S/C19H20N4O2/c1-3-14(15-9-16(22-21-15)19(24)25-4-2)17-11-23-10-13(12-5-6-12)7-8-18(23)20-17/h3,7-12H,4-6H2,1-2H3,(H,21,22)/b14-3+
InChIKeyILCMZSWAQBTSDB-LZWSPWQCSA-N
XLogP3.56
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate with MolForge

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Related Compounds

ethyl 6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridine-2-carboxylate
CID 165131953
ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate
CID 139487437
ethane;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate
CID 156707965
ethyl 4-chloro-6-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methoxy]pyrimidine-2-carboxylate
CID 165130837
ethyl 3-(4-cyclohexylphenyl)-1H-pyrazole-5-carboxylate
CID 75357944
CID 160990590
CID 160990590
ethane;ethyl 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methanamine
CID 165132115
6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 139487962
ethyl 6-chloroimidazo[1,2-a]pyridine-2-carboxylate;hydrobromide
CID 17389574
ethyl 3-[(3E,5Z)-hepta-1,3,5-trien-4-yl]-1H-pyrazole-5-carboxylate
CID 143301397
ethyl 2-amino-2-[[2-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)acetyl]hydrazinylidene]acetate
CID 150821073
(Z)-2-amino-1-[amino-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]pent-1-en-3-one
CID 175622793

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate?
The IUPAC name of ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate (CID 156708813) is ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate.
What is the SMILES notation for ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate?
The canonical SMILES for ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate is C/C=C(\c1cc(C(=O)OCC)[nH]n1)c1cn2cc(C3CC3)ccc2n1.
What is the InChIKey of ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate?
The InChIKey is ILCMZSWAQBTSDB-LZWSPWQCSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-3-14(15-9-16(22-21-15)19(24)25-4-2)17-11-23-10-13(12-5-6-12)7-8-18(23)20-17/h3,7-12H,4-6H2,1-2H3,(H,21,22)/b14-3+.
What are the key properties of ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate?
ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate has a molecular weight of 336.40 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[(Z)-1-(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)prop-1-enyl]-1H-pyrazole-5-carboxylate is sourced from PubChem (CID 156708813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).