N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide

C10H15N5O2 — CID 118672144

IUPACN-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide
SMILESCCC(=O)Nc1nc(C)nc(NC(=O)CC)n1
InChIInChI=1S/C10H15N5O2/c1-4-7(16)13-9-11-6(3)12-10(15-9)14-8(17)5-2/h4-5H2,1-3H3,(H2,11,12,13,14,15,16,17)
InChIKeySFIWIIHBGRBUPF-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.88
Rot. Bonds4

About N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide

N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide (PubChem CID 118672144) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide.

Molecular Properties

Compound NameN-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide
PubChem CID118672144
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC NameN-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide
SMILESCCC(=O)Nc1nc(C)nc(NC(=O)CC)n1
InChIInChI=1S/C10H15N5O2/c1-4-7(16)13-9-11-6(3)12-10(15-9)14-8(17)5-2/h4-5H2,1-3H3,(H2,11,12,13,14,15,16,17)
InChIKeySFIWIIHBGRBUPF-UHFFFAOYSA-N
XLogP0.88
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide?
The IUPAC name of N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide (CID 118672144) is N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide.
What is the SMILES notation for N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide?
The canonical SMILES for N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide is CCC(=O)Nc1nc(C)nc(NC(=O)CC)n1.
What is the InChIKey of N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide?
The InChIKey is SFIWIIHBGRBUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c1-4-7(16)13-9-11-6(3)12-10(15-9)14-8(17)5-2/h4-5H2,1-3H3,(H2,11,12,13,14,15,16,17).
What are the key properties of N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide?
N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide has a molecular weight of 237.26 g/mol, XLogP of 0.88, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide is sourced from PubChem (CID 118672144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).