4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile

C14H16N6O2 — CID 10063365

IUPAC4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
SMILESN#Cc1nc(NCCc2ccco2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H16N6O2/c15-10-12-17-13(16-4-3-11-2-1-7-22-11)19-14(18-12)20-5-8-21-9-6-20/h1-2,7H,3-6,8-9H2,(H,16,17,18,19)
InChIKeyHKYNATOIQKWVMA-UHFFFAOYSA-N
MW300.32 g/mol
LogP0.83
Rot. Bonds5

About 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile

4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile (PubChem CID 10063365) has the molecular formula C14H16N6O2 and a molecular weight of 300.32 g/mol. Its IUPAC name is 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile.

Molecular Properties

Compound Name4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
PubChem CID10063365
Molecular FormulaC14H16N6O2
Molecular Weight300.32 g/mol
Exact Mass300.13
IUPAC Name4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
SMILESN#Cc1nc(NCCc2ccco2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H16N6O2/c15-10-12-17-13(16-4-3-11-2-1-7-22-11)19-14(18-12)20-5-8-21-9-6-20/h1-2,7H,3-6,8-9H2,(H,16,17,18,19)
InChIKeyHKYNATOIQKWVMA-UHFFFAOYSA-N
XLogP0.83
TPSA100.10 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[[4-(furan-2-ylmethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-methylpropan-1-ol
CID 821246
4-[(2E)-2-benzylidenehydrazinyl]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 110178614
ethyl 2-[(4-cyano-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]acetate
CID 712287
4-(furan-2-ylmethylsulfanyl)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80872582
2-(furan-2-yl)-N-(2-morpholin-4-ylethyl)ethanamine
CID 60695276
4-chloro-6-morpholin-4-yl-N-(2-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 58508232
4-[2-(furan-2-yl)ethylamino]benzonitrile
CID 60701833
N-[2-(furan-2-yl)ethyl]-4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80900930
2-N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-6-morpholin-4-yl-4-N-(2-phenylethyl)-1,3,5-triazine-2,4-diamine
CID 23758298
6-chloro-4-N-ethyl-2-N-[2-(furan-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 80802955
4-chloro-N-[(5-methylfuran-2-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62864878
N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]ethane-1,2-diamine
CID 155812807

Frequently Asked Questions

What is the IUPAC name of 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile?
The IUPAC name of 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile (CID 10063365) is 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile.
What is the SMILES notation for 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile?
The canonical SMILES for 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile is N#Cc1nc(NCCc2ccco2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile?
The InChIKey is HKYNATOIQKWVMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O2/c15-10-12-17-13(16-4-3-11-2-1-7-22-11)19-14(18-12)20-5-8-21-9-6-20/h1-2,7H,3-6,8-9H2,(H,16,17,18,19).
What are the key properties of 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile?
4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile has a molecular weight of 300.32 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(furan-2-yl)ethylamino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile is sourced from PubChem (CID 10063365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).