(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine

C17H16N4O2 — CID 20832121

IUPAC(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine
SMILESCN1C/C(=C/c2ccco2)c2nc(N)nc(-c3ccco3)c2C1
InChIInChI=1S/C17H16N4O2/c1-21-9-11(8-12-4-2-6-22-12)15-13(10-21)16(20-17(18)19-15)14-5-3-7-23-14/h2-8H,9-10H2,1H3,(H2,18,19,20)/b11-8-
InChIKeyCWKSCGLFYTXHIF-FLIBITNWSA-N
MW308.34 g/mol
LogP2.90
Rot. Bonds2

About (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine

(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine (PubChem CID 20832121) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine
PubChem CID20832121
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine
SMILESCN1C/C(=C/c2ccco2)c2nc(N)nc(-c3ccco3)c2C1
InChIInChI=1S/C17H16N4O2/c1-21-9-11(8-12-4-2-6-22-12)15-13(10-21)16(20-17(18)19-15)14-5-3-7-23-14/h2-8H,9-10H2,1H3,(H2,18,19,20)/b11-8-
InChIKeyCWKSCGLFYTXHIF-FLIBITNWSA-N
XLogP2.90
TPSA81.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,5-bis(furan-2-ylmethylidene)-1-methylpiperidin-4-one
CID 717827
5-bromo-4,6-bis(furan-2-yl)pyrimidin-2-amine
CID 23020456
(5Z)-5-(furan-2-ylmethylidene)-1,3-dimethyl-1,3-diazinane-2,4-dione
CID 177456796
1-[5-amino-3-(furan-2-yl)-1,2,4-triazol-1-yl]ethanone
CID 757187
4-tert-butyl-6-(furan-2-yl)-1,3,5-triazin-2-amine
CID 63868616
4-(furan-2-yl)-5-iodo-6-methylsulfinylpyrimidin-2-amine
CID 18507211
5-ethyl-4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine
CID 18507240
9-[(E)-but-2-enyl]-6-(furan-2-yl)purin-2-amine
CID 59834966
6-[(E)-2-(furan-2-yl)ethenyl]-1,3,5-triazine-2,4-diamine
CID 12693892
(5E)-2-amino-5-(furan-2-ylmethylidene)-1-methylimidazol-4-one
CID 15210890
2-[2-amino-6-(furan-2-yl)purin-9-yl]-N-methylacetamide
CID 59834969
(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
CID 95568888

Frequently Asked Questions

What is the IUPAC name of (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine?
The IUPAC name of (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine (CID 20832121) is (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine.
What is the SMILES notation for (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine?
The canonical SMILES for (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine is CN1C/C(=C/c2ccco2)c2nc(N)nc(-c3ccco3)c2C1.
What is the InChIKey of (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine?
The InChIKey is CWKSCGLFYTXHIF-FLIBITNWSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-21-9-11(8-12-4-2-6-22-12)15-13(10-21)16(20-17(18)19-15)14-5-3-7-23-14/h2-8H,9-10H2,1H3,(H2,18,19,20)/b11-8-.
What are the key properties of (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine?
(8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine has a molecular weight of 308.34 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (8Z)-4-(furan-2-yl)-8-(furan-2-ylmethylidene)-6-methyl-5,7-dihydropyrido[4,3-d]pyrimidin-2-amine is sourced from PubChem (CID 20832121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).