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

C10H13N5O — CID 59874296

IUPAC2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C10H13N5O/c1-6(8-4-3-5-16-8)12-10-14-7(2)13-9(11)15-10/h3-6H,1-2H3,(H3,11,12,13,14,15)
InChIKeyTVAZJINZJZQHHU-UHFFFAOYSA-N
MW219.25 g/mol
LogP1.53
Rot. Bonds3

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

2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 59874296) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine
PubChem CID59874296
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C10H13N5O/c1-6(8-4-3-5-16-8)12-10-14-7(2)13-9(11)15-10/h3-6H,1-2H3,(H3,11,12,13,14,15)
InChIKeyTVAZJINZJZQHHU-UHFFFAOYSA-N
XLogP1.53
TPSA89.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-Furanyl)-1,3,5-triazine-2,4-diamine
CID 20813
N-allyl-6-chloro-N'-(2-furylmethyl)-1,3,5-triazine-2,4-diamine
CID 2053611
2-[[4-Chloro-6-(furan-2-ylmethylamino)-1,3,5-triazin-2-yl]amino]ethanol
CID 3141862
4-chloro-N-(furan-2-ylmethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 790434
N-Allyl-6-ethoxy-N'-furan-2-ylmethyl-[1,3,5]triazine-2,4-diamine
CID 649892
6-Chloro-N-furan-2-ylmethyl-N',N'-dipropyl-[1,3,5]triazine-2,4-diamine
CID 695780
6-Ethoxy-N-furan-2-ylmethyl-N'-hexyl-[1,3,5]triazine-2,4-diamine
CID 3128957
4-(Furan-2-yl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
CID 618598
6-(2-Furyl)-N,N-dimethyl-1,3,5-triazine-2,4-diamine
CID 745956
N-cyclohexyl-N-{4-[(2-furylmethyl)amino]-6-methoxy-1,3,5-triazin-2-yl}amine
CID 821248
6-Chloro-N-furan-2-ylmethyl-N'-octyl-[1,3,5]triazine-2,4-diamine
CID 3121128
s-Triazine, 2,4-bis(dimethylamino)-6-(2-furyl)-
CID 3039316

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine (CID 59874296) is 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine is Cc1nc(N)nc(NC(C)c2ccco2)n1.
What is the InChIKey of 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is TVAZJINZJZQHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-6(8-4-3-5-16-8)12-10-14-7(2)13-9(11)15-10/h3-6H,1-2H3,(H3,11,12,13,14,15).
What are the key properties of 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine?
2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 219.25 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(furan-2-yl)ethyl]-6-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 59874296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).