N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide

C19H15FN4O3 — CID 91892641

IUPACN-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide
SMILESO=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1ccoc1
InChIInChI=1S/C19H15FN4O3/c20-15-3-1-13(2-4-15)16-11-17-19(26)23(8-9-24(17)22-16)7-6-21-18(25)14-5-10-27-12-14/h1-5,8-12H,6-7H2,(H,21,25)
InChIKeyUGSXNAOPMMIOKY-UHFFFAOYSA-N
MW366.35 g/mol
LogP2.33
Rot. Bonds5

About N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide

N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide (PubChem CID 91892641) has the molecular formula C19H15FN4O3 and a molecular weight of 366.35 g/mol. Its IUPAC name is N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide
PubChem CID91892641
Molecular FormulaC19H15FN4O3
Molecular Weight366.35 g/mol
Exact Mass366.11
IUPAC NameN-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide
SMILESO=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1ccoc1
InChIInChI=1S/C19H15FN4O3/c20-15-3-1-13(2-4-15)16-11-17-19(26)23(8-9-24(17)22-16)7-6-21-18(25)14-5-10-27-12-14/h1-5,8-12H,6-7H2,(H,21,25)
InChIKeyUGSXNAOPMMIOKY-UHFFFAOYSA-N
XLogP2.33
TPSA81.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-((3r,5s)-1-(Benzofuran-3-Carbonyl)-5-(Ethylcarbamoyl)pyrrolidin-3-Yl)-3-Ethyl-1-Methyl-1h-Pyrazole-5-Carboxamide
CID 72725792
N-(4-{N-[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]ethanehydrazonoyl}phenyl)-2-methyl-3-furamide
CID 5433092
N-(4-{N-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]ethanehydrazonoyl}phenyl)-2-methyl-3-furamide
CID 5454921
N-(3-{N-[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]ethanehydrazonoyl}phenyl)-2-methyl-3-furamide
CID 9617778
2-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]furan-3-carboxamide
CID 1244259
2-[1-(3-furylmethyl)-3-oxopiperazin-2-yl]-N-[3-(1H-indazol-1-yl)propyl]acetamide
CID 16188787
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CID 20919735
1-(2,5-dimethyl-3-furoyl)-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-2-piperidinecarboxamide
CID 24791263
N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-1-(2-methyl-3-furoyl)-2-piperidinecarboxamide
CID 24816693
N-[1-(4-fluorophenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazol-4-yl]-3-furamide
CID 24817114
N-[(3R,5S)-1-(1-benzofuran-3-carbonyl)-5-(cyclopentylcarbamoyl)pyrrolidin-3-yl]-3-ethyl-1-methylpyrazole-5-carboxamide
CID 76314523
N-[(3R,5S)-1-(1-benzofuran-3-carbonyl)-5-carbamoylpyrrolidin-3-yl]-1,3-diethylpyrazole-5-carboxamide
CID 76314530

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide?
The IUPAC name of N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide (CID 91892641) is N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide?
The canonical SMILES for N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide is O=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1ccoc1.
What is the InChIKey of N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide?
The InChIKey is UGSXNAOPMMIOKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O3/c20-15-3-1-13(2-4-15)16-11-17-19(26)23(8-9-24(17)22-16)7-6-21-18(25)14-5-10-27-12-14/h1-5,8-12H,6-7H2,(H,21,25).
What are the key properties of N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide?
N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide has a molecular weight of 366.35 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide is sourced from PubChem (CID 91892641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).