N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide

C12H15N5O2 — CID 59874367

IUPACN-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C12H15N5O2/c1-7(10-5-4-6-19-10)13-11-14-8(2)15-12(17-11)16-9(3)18/h4-7H,1-3H3,(H2,13,14,15,16,17,18)
InChIKeyFRICWGIJANDHMU-UHFFFAOYSA-N
MW261.29 g/mol
LogP1.90
Rot. Bonds4

About N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide

N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide (PubChem CID 59874367) has the molecular formula C12H15N5O2 and a molecular weight of 261.29 g/mol. Its IUPAC name is N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
PubChem CID59874367
Molecular FormulaC12H15N5O2
Molecular Weight261.29 g/mol
Exact Mass261.12
IUPAC NameN-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C12H15N5O2/c1-7(10-5-4-6-19-10)13-11-14-8(2)15-12(17-11)16-9(3)18/h4-7H,1-3H3,(H2,13,14,15,16,17,18)
InChIKeyFRICWGIJANDHMU-UHFFFAOYSA-N
XLogP1.90
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

methane;N-[4-methyl-6-[1-(3-methylthiophen-2-yl)ethylamino]-1,3,5-triazin-2-yl]acetamide
CID 160849117
N-[4-methyl-6-[1-(4-methylsulfonylphenyl)ethylamino]-1,3,5-triazin-2-yl]acetamide
CID 22965457
N-[1-(furan-2-yl)ethyl]acetamide
CID 22460009
N-[4-[1-(3-chlorothiophen-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
CID 59874327
N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112691697
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
2-[1-(furan-2-yl)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid
CID 80570272
N-[1-(furan-2-yl)ethyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66325662
3,5-diacetamido-N-[1-(furan-2-yl)ethyl]benzamide
CID 18110352
N-[3-[1-(furan-2-yl)ethylamino]phenyl]-2-methylpropanamide
CID 43725755
N-(4,6-diacetamido-1,3,5-triazin-2-yl)acetamide
CID 21856
4-N-ethyl-2-N-[1-(furan-2-yl)ethyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80775608

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The IUPAC name of N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide (CID 59874367) is N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide.
What is the SMILES notation for N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The canonical SMILES for N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide is CC(=O)Nc1nc(C)nc(NC(C)c2ccco2)n1.
What is the InChIKey of N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The InChIKey is FRICWGIJANDHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-7(10-5-4-6-19-10)13-11-14-8(2)15-12(17-11)16-9(3)18/h4-7H,1-3H3,(H2,13,14,15,16,17,18).
What are the key properties of N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide has a molecular weight of 261.29 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide is sourced from PubChem (CID 59874367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).