ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate

C14H18N4O2 — CID 115372977

IUPACethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2ccn3nccc3n2)CC1
InChIInChI=1S/C14H18N4O2/c1-2-20-14(19)11-4-8-17(9-5-11)12-6-10-18-13(16-12)3-7-15-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3
InChIKeyULDVALOAESBGCU-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.51
Rot. Bonds3

About ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate

ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate (PubChem CID 115372977) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate
PubChem CID115372977
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Nameethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2ccn3nccc3n2)CC1
InChIInChI=1S/C14H18N4O2/c1-2-20-14(19)11-4-8-17(9-5-11)12-6-10-18-13(16-12)3-7-15-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3
InChIKeyULDVALOAESBGCU-UHFFFAOYSA-N
XLogP1.51
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 1-(5-chloro-6-methyl-2-pyridinyl)piperidine-4-carboxylate
CID 170716467
N-methyl-1-(1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidin-4-yl)ethanamine
CID 115371982
ethyl 1-(4-amino-2-pyridinyl)piperidine-4-carboxylate
CID 68568819
ethyl 1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)piperidine-4-carboxylate
CID 103201110
ethyl 1-(3-oxo-2H-1,2,4-triazin-5-yl)piperidine-4-carboxylate
CID 9124455
ethyl 1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidine-4-carboxylate
CID 66334132
ethyl (3S)-1-(2-chloropyrimidin-4-yl)pyrrolidine-3-carboxylate
CID 129499368
ethyl 1-(6-methoxyquinolin-2-yl)piperidine-4-carboxylate
CID 141431671
ethyl 1-(1-methylimidazol-2-yl)piperidine-4-carboxylate
CID 62131854
ethyl 1-(5-acetyl-2-pyridinyl)piperidine-4-carboxylate
CID 66656004
ethyl 2-(4-ethoxycarbonylpiperidin-1-yl)pyridine-3-carboxylate
CID 71741541
ethyl 1-(6-pyridin-4-ylquinolin-2-yl)piperidine-4-carboxylate;hydrochloride
CID 156801017

Frequently Asked Questions

What is the IUPAC name of ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate?
The IUPAC name of ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate (CID 115372977) is ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate.
What is the SMILES notation for ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate?
The canonical SMILES for ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate is CCOC(=O)C1CCN(c2ccn3nccc3n2)CC1.
What is the InChIKey of ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate?
The InChIKey is ULDVALOAESBGCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-20-14(19)11-4-8-17(9-5-11)12-6-10-18-13(16-12)3-7-15-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3.
What are the key properties of ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate?
ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate has a molecular weight of 274.32 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate is sourced from PubChem (CID 115372977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).