2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

C13H9N5O — CID 14031894

IUPAC2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
SMILESNc1nc2ccccc2c2nc(-c3ccco3)nn12
InChIInChI=1S/C13H9N5O/c14-13-15-9-5-2-1-4-8(9)12-16-11(17-18(12)13)10-6-3-7-19-10/h1-7H,(H2,14,15)
InChIKeyWTQTWLIUVOLCCQ-UHFFFAOYSA-N
MW251.25 g/mol
LogP2.12
Rot. Bonds1

About 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine (PubChem CID 14031894) has the molecular formula C13H9N5O and a molecular weight of 251.25 g/mol. Its IUPAC name is 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
PubChem CID14031894
Molecular FormulaC13H9N5O
Molecular Weight251.25 g/mol
Exact Mass251.08
IUPAC Name2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
SMILESNc1nc2ccccc2c2nc(-c3ccco3)nn12
InChIInChI=1S/C13H9N5O/c14-13-15-9-5-2-1-4-8(9)12-16-11(17-18(12)13)10-6-3-7-19-10/h1-7H,(H2,14,15)
InChIKeyWTQTWLIUVOLCCQ-UHFFFAOYSA-N
XLogP2.12
TPSA82.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(furan-2-yl)-3,5,6,8,12-pentazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaen-7-amine
CID 14458845
4-(furan-2-yl)-11-methyl-3,5,6,8,11-pentazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-amine
CID 57402117
4-(furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-amine
CID 10587109
11-(furan-2-yl)-3-(2-phenylethyl)-3,4,7,9,10,12-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2(6),4,7,10-pentaen-8-amine
CID 57391694
10-[2-(1,3-dihydroisoindol-2-yl)ethyl]-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 10126504
4-[2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-11-yl]ethyl]phenol
CID 21220573
2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-11-yl]-3-methylbutanoic acid
CID 146327882
2-propan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 176762101
8-chloro-2,7-bis(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 110170648
4-(furan-2-yl)-10-(2-phenylethyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7-tetraen-7-amine
CID 21030622
N-[(4-fluorophenyl)methyl]-2-[[2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetamide
CID 71907012
(2S)-2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-N-methyl-2-phenylacetamide
CID 146186369

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine?
The IUPAC name of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine (CID 14031894) is 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine.
What is the SMILES notation for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine?
The canonical SMILES for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine is Nc1nc2ccccc2c2nc(-c3ccco3)nn12.
What is the InChIKey of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine?
The InChIKey is WTQTWLIUVOLCCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5O/c14-13-15-9-5-2-1-4-8(9)12-16-11(17-18(12)13)10-6-3-7-19-10/h1-7H,(H2,14,15).
What are the key properties of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine?
2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine has a molecular weight of 251.25 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine is sourced from PubChem (CID 14031894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).