2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline

C16H10N6O — CID 6419284

IUPAC2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline
SMILESc1coc(-c2cc(-c3nc4c5ccccc5ncn4n3)n[nH]2)c1
InChIInChI=1S/C16H10N6O/c1-2-5-11-10(4-1)16-18-15(21-22(16)9-17-11)13-8-12(19-20-13)14-6-3-7-23-14/h1-9H,(H,19,20)
InChIKeySQSJCETXKOJMRI-UHFFFAOYSA-N
MW302.30 g/mol
LogP2.93
Rot. Bonds2

About 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline

2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline (PubChem CID 6419284) has the molecular formula C16H10N6O and a molecular weight of 302.30 g/mol. Its IUPAC name is 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline
PubChem CID6419284
Molecular FormulaC16H10N6O
Molecular Weight302.30 g/mol
Exact Mass302.09
IUPAC Name2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline
SMILESc1coc(-c2cc(-c3nc4c5ccccc5ncn4n3)n[nH]2)c1
InChIInChI=1S/C16H10N6O/c1-2-5-11-10(4-1)16-18-15(21-22(16)9-17-11)13-8-12(19-20-13)14-6-3-7-23-14/h1-9H,(H,19,20)
InChIKeySQSJCETXKOJMRI-UHFFFAOYSA-N
XLogP2.93
TPSA84.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Vipadenant
CID 21874557
3-[(4-Amino-3-ethylphenyl)methyl]-7-(furan-2-yl)triazolo[4,5-d]pyrimidin-5-amine
CID 21874756
3-((S)-2-amino-3-(1H-indol-3-yl)propoxy)-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-2-amine
CID 25190977
(S)-1-(6-(furan-3-yl)-5-(3-methyl-1H-pyrazolo[3,4-b]pyridin-5-yl)pyridin-3-yloxy)-3-(1H-indol-3-yl)propan-2-amine
CID 46225572
N-[4-(5-furan-2-yl-3-methyl-1h-pyrazol-4-yl)butyl]-n-methyl-7h-purin-6-amine
CID 46238526
10-[3-(4-Aminophenyl)propyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
CID 10904839
3-((S)-2-amino-3-(1H-indol-3-yl)propoxy)-5-(3-methyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-6-(2-methylfuran-3-yl)pyridin-2-amine
CID 46226080
3-((2S)-2-amino-3-(2-amino-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propyl)-1H-indole-2-carbonitrile
CID 46226137
3-((2S)-2-amino-3-(2-amino-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propyl)-1H-indole-2-carboxamide
CID 46226156
(2S)-1-(1H-indol-3-yl)-3-(5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propan-2-amine
CID 46226417
5-Furan-2-yl-7-trifluoromethyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid [3,5-dimethyl-1-(2-methyl-benzyl)-1H-pyrazol-4-yl]-amide
CID 651382
(3,4-Dihydro-2H-quinolin-1-yl)-(5-furan-2-yl-7-trifluoromethyl-pyrazolo[1,5-a]pyrimidin-2-yl)-methanone
CID 654073

Frequently Asked Questions

What is the IUPAC name of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline?
The IUPAC name of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline (CID 6419284) is 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline.
What is the SMILES notation for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline?
The canonical SMILES for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline is c1coc(-c2cc(-c3nc4c5ccccc5ncn4n3)n[nH]2)c1.
What is the InChIKey of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline?
The InChIKey is SQSJCETXKOJMRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N6O/c1-2-5-11-10(4-1)16-18-15(21-22(16)9-17-11)13-8-12(19-20-13)14-6-3-7-23-14/h1-9H,(H,19,20).
What are the key properties of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline?
2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline has a molecular weight of 302.30 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-c]quinazoline is sourced from PubChem (CID 6419284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).