2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine

C14H22N6O — CID 80773788

IUPAC2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(NC)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C14H22N6O/c1-5-20(6-2)14-18-12(15-4)17-13(19-14)16-10(3)11-8-7-9-21-11/h7-10H,5-6H2,1-4H3,(H2,15,16,17,18,19)
InChIKeyHPNWSYHLXRVPHP-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.53
Rot. Bonds7

About 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80773788) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine
PubChem CID80773788
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(NC)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C14H22N6O/c1-5-20(6-2)14-18-12(15-4)17-13(19-14)16-10(3)11-8-7-9-21-11/h7-10H,5-6H2,1-4H3,(H2,15,16,17,18,19)
InChIKeyHPNWSYHLXRVPHP-UHFFFAOYSA-N
XLogP2.53
TPSA79.11 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

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Related Compounds

6-chloro-2-N,2-N-diethyl-4-N-[1-(furan-2-yl)propan-2-yl]-1,3,5-triazine-2,4-diamine
CID 62864795
4-N-ethyl-2-N-[1-(furan-2-yl)ethyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80775608
2-N,2-N,6-N-triethyl-4-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 80750440
4-N-tert-butyl-2-N,2-N-diethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80768855
N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
CID 59874367
N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112691697
N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 60727078
2-N,2-N-diethyl-4-N,6-N-dimethyl-4-N-(3-methylbutan-2-yl)-1,3,5-triazine-2,4,6-triamine
CID 80792678
2-N,2-N-diethyl-6-N-methyl-4-N-(pyridin-4-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 80773355
4-N,4-N-diethyl-6-hydrazinyl-2-N-(1-thiophen-3-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80904735
N,N-diethyl-4-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]aniline
CID 81403321
2-N,2-N-diethyl-4-N-methyl-6-pyridin-2-ylsulfanyl-1,3,5-triazine-2,4-diamine
CID 80882962

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine (CID 80773788) is 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine is CCN(CC)c1nc(NC)nc(NC(C)c2ccco2)n1.
What is the InChIKey of 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is HPNWSYHLXRVPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-5-20(6-2)14-18-12(15-4)17-13(19-14)16-10(3)11-8-7-9-21-11/h7-10H,5-6H2,1-4H3,(H2,15,16,17,18,19).
What are the key properties of 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 290.37 g/mol, XLogP of 2.53, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80773788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).