8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine

C13H14N4O — CID 44523362

IUPAC8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine
SMILESCC(C)c1cc2c(ccc3nc(N)nc(N)c32)o1
InChIInChI=1S/C13H14N4O/c1-6(2)10-5-7-9(18-10)4-3-8-11(7)12(14)17-13(15)16-8/h3-6H,1-2H3,(H4,14,15,16,17)
InChIKeyGRVXIGBRVPMDKY-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.66
Rot. Bonds1

About 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine

8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine (PubChem CID 44523362) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine.

Molecular Properties

Compound Name8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine
PubChem CID44523362
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine
SMILESCC(C)c1cc2c(ccc3nc(N)nc(N)c32)o1
InChIInChI=1S/C13H14N4O/c1-6(2)10-5-7-9(18-10)4-3-8-11(7)12(14)17-13(15)16-8/h3-6H,1-2H3,(H4,14,15,16,17)
InChIKeyGRVXIGBRVPMDKY-UHFFFAOYSA-N
XLogP2.66
TPSA90.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine?
The IUPAC name of 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine (CID 44523362) is 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine.
What is the SMILES notation for 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine?
The canonical SMILES for 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine is CC(C)c1cc2c(ccc3nc(N)nc(N)c32)o1.
What is the InChIKey of 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine?
The InChIKey is GRVXIGBRVPMDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-6(2)10-5-7-9(18-10)4-3-8-11(7)12(14)17-13(15)16-8/h3-6H,1-2H3,(H4,14,15,16,17).
What are the key properties of 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine?
8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine has a molecular weight of 242.28 g/mol, XLogP of 2.66, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-ylfuro[3,2-f]quinazoline-1,3-diamine is sourced from PubChem (CID 44523362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).