N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide

C9H10N4O2 — CID 79503855

IUPACN-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide
SMILESN#Cc1cn[nH]c1NC(=O)C1CCOC1
InChIInChI=1S/C9H10N4O2/c10-3-7-4-11-13-8(7)12-9(14)6-1-2-15-5-6/h4,6H,1-2,5H2,(H2,11,12,13,14)
InChIKeyPMCFPIJCPFKRHY-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.26
Rot. Bonds2

About N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide

N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide (PubChem CID 79503855) has the molecular formula C9H10N4O2 and a molecular weight of 206.20 g/mol. Its IUPAC name is N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide
PubChem CID79503855
Molecular FormulaC9H10N4O2
Molecular Weight206.20 g/mol
Exact Mass206.08
IUPAC NameN-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide
SMILESN#Cc1cn[nH]c1NC(=O)C1CCOC1
InChIInChI=1S/C9H10N4O2/c10-3-7-4-11-13-8(7)12-9(14)6-1-2-15-5-6/h4,6H,1-2,5H2,(H2,11,12,13,14)
InChIKeyPMCFPIJCPFKRHY-UHFFFAOYSA-N
XLogP0.26
TPSA90.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyano-1H-pyrazol-5-yl)-2,2-dimethylcyclopropane-1-carboxamide
CID 107001533
N-(3-bromo-4-cyanophenyl)oxolane-3-carboxamide
CID 112736097
N-(4-ethyl-1H-pyrazol-5-yl)oxane-4-carboxamide
CID 115680700
N-(3-cyano-4-piperazin-1-ylphenyl)oxolane-3-carboxamide
CID 57336447
3-(4-cyano-1H-pyrazol-5-yl)-1,1-diethylurea
CID 79503578
N-(4-cyano-1H-pyrazol-5-yl)-3-methylpiperidine-1-carboxamide
CID 79503954
N-(4-cyano-1H-pyrazol-5-yl)-1,3-dihydro-2-benzofuran-5-carboxamide
CID 79503179
N-(4-cyano-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
CID 79504211
N-(4-cyano-1H-pyrazol-5-yl)-3-oxobutanamide
CID 110470623
N-(2-cyano-3-fluorophenyl)oxolane-3-carboxamide
CID 61276767
N-(4,5-dimethyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 115609939
(3R)-N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]oxolane-3-carboxamide
CID 95271562

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide?
The IUPAC name of N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide (CID 79503855) is N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide.
What is the SMILES notation for N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide?
The canonical SMILES for N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide is N#Cc1cn[nH]c1NC(=O)C1CCOC1.
What is the InChIKey of N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide?
The InChIKey is PMCFPIJCPFKRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c10-3-7-4-11-13-8(7)12-9(14)6-1-2-15-5-6/h4,6H,1-2,5H2,(H2,11,12,13,14).
What are the key properties of N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide?
N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide has a molecular weight of 206.20 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1H-pyrazol-5-yl)oxolane-3-carboxamide is sourced from PubChem (CID 79503855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).