ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate

C13H11N3O2 — CID 10610124

IUPACethyl pyrazolo[1,5-c]quinazoline-2-carboxylate
SMILESCCOC(=O)c1cc2c3ccccc3ncn2n1
InChIInChI=1S/C13H11N3O2/c1-2-18-13(17)11-7-12-9-5-3-4-6-10(9)14-8-16(12)15-11/h3-8H,2H2,1H3
InChIKeyANCGBLLDLGYQEA-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.06
Rot. Bonds2

About ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate

ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate (PubChem CID 10610124) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate.

Molecular Properties

Compound Nameethyl pyrazolo[1,5-c]quinazoline-2-carboxylate
PubChem CID10610124
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC Nameethyl pyrazolo[1,5-c]quinazoline-2-carboxylate
SMILESCCOC(=O)c1cc2c3ccccc3ncn2n1
InChIInChI=1S/C13H11N3O2/c1-2-18-13(17)11-7-12-9-5-3-4-6-10(9)14-8-16(12)15-11/h3-8H,2H2,1H3
InChIKeyANCGBLLDLGYQEA-UHFFFAOYSA-N
XLogP2.06
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 13-methyl-8,10,12,15,16-pentazatetracyclo[8.6.0.02,7.011,15]hexadeca-1(16),2,4,6,8,11,13-heptaene-14-carboxylate
CID 11358368
ethyl 4-fluoroquinoline-2-carboxylate
CID 125473134
2-(2-ethoxycarbonylquinolin-4-yl)oxyacetic acid
CID 68600255
ethyl 2,5-dimethylpyrazolo[1,5-a]quinoline-3-carboxylate
CID 102144497
ethyl quinoxaline-2-carboxylate
CID 582701
ethyl 5-methyl-1-phenylpyrazole-3-carboxylate
CID 10900438
ethyl 4-(methylcarbamoyl)pyrazolo[1,5-a]pyridine-2-carboxylate
CID 59539012
ethane;ethyl 4-aminoquinoline-3-carboxylate
CID 143157176
ethyl 5-amino-1-phenylpyrazole-3-carboxylate
CID 23630921
ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate
CID 155346646
ethyl pyridine-2-carboxylate
CID 17307
ethyl 5-bromoimidazo[1,2-a]quinoline-2-carboxylate
CID 12763980

Frequently Asked Questions

What is the IUPAC name of ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate?
The IUPAC name of ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate (CID 10610124) is ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate.
What is the SMILES notation for ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate?
The canonical SMILES for ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate is CCOC(=O)c1cc2c3ccccc3ncn2n1.
What is the InChIKey of ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate?
The InChIKey is ANCGBLLDLGYQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c1-2-18-13(17)11-7-12-9-5-3-4-6-10(9)14-8-16(12)15-11/h3-8H,2H2,1H3.
What are the key properties of ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate?
ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate has a molecular weight of 241.25 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate is sourced from PubChem (CID 10610124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).