2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

C13H18N6O2 — CID 80774193

IUPAC2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCC(Nc1nc(N)nc(N2CCOCC2)n1)c1ccco1
InChIInChI=1S/C13H18N6O2/c1-9(10-3-2-6-21-10)15-12-16-11(14)17-13(18-12)19-4-7-20-8-5-19/h2-3,6,9H,4-5,7-8H2,1H3,(H3,14,15,16,17,18)
InChIKeyKVGDJDFKTOLMFB-UHFFFAOYSA-N
MW290.33 g/mol
LogP1.06
Rot. Bonds4

About 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (PubChem CID 80774193) has the molecular formula C13H18N6O2 and a molecular weight of 290.33 g/mol. Its IUPAC name is 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
PubChem CID80774193
Molecular FormulaC13H18N6O2
Molecular Weight290.33 g/mol
Exact Mass290.15
IUPAC Name2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCC(Nc1nc(N)nc(N2CCOCC2)n1)c1ccco1
InChIInChI=1S/C13H18N6O2/c1-9(10-3-2-6-21-10)15-12-16-11(14)17-13(18-12)19-4-7-20-8-5-19/h2-3,6,9H,4-5,7-8H2,1H3,(H3,14,15,16,17,18)
InChIKeyKVGDJDFKTOLMFB-UHFFFAOYSA-N
XLogP1.06
TPSA102.33 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

2-N-[1-(furan-2-yl)ethyl]-6-(1,2,4-triazol-1-yl)-1,3,5-triazine-2,4-diamine
CID 80780901
2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80770087
6-morpholin-4-yl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 22115031
2-N-(4-methoxybutan-2-yl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80844752
2-N-heptan-2-yl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80781816
2-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]-N,N-dimethylpropanamide
CID 80781706
ethyl 2-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]propanoate
CID 80783472
2-N-(4-methylphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80751542
4-morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868604
(1R)-1-(furan-2-yl)-N-[(4-morpholin-4-ylphenyl)methyl]ethanamine
CID 81391853
2-N-[(2-methylpyrazol-3-yl)methyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80814477
2-N-[2-[methyl(propan-2-yl)amino]ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80803084

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (CID 80774193) is 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is CC(Nc1nc(N)nc(N2CCOCC2)n1)c1ccco1.
What is the InChIKey of 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is KVGDJDFKTOLMFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O2/c1-9(10-3-2-6-21-10)15-12-16-11(14)17-13(18-12)19-4-7-20-8-5-19/h2-3,6,9H,4-5,7-8H2,1H3,(H3,14,15,16,17,18).
What are the key properties of 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 290.33 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(furan-2-yl)ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80774193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).