N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide

C12H18N6O2 — CID 2730056

IUPACN-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide
SMILESCC(=O)Nc1nc(NC(C)=O)nc(N2CCCCC2)n1
InChIInChI=1S/C12H18N6O2/c1-8(19)13-10-15-11(14-9(2)20)17-12(16-10)18-6-4-3-5-7-18/h3-7H2,1-2H3,(H2,13,14,15,16,17,19,20)
InChIKeyBGVOFXKXVZGAMO-UHFFFAOYSA-N
MW278.32 g/mol
LogP0.78
Rot. Bonds3

About N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide

N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide (PubChem CID 2730056) has the molecular formula C12H18N6O2 and a molecular weight of 278.32 g/mol. Its IUPAC name is N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide
PubChem CID2730056
Molecular FormulaC12H18N6O2
Molecular Weight278.32 g/mol
Exact Mass278.15
IUPAC NameN-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide
SMILESCC(=O)Nc1nc(NC(C)=O)nc(N2CCCCC2)n1
InChIInChI=1S/C12H18N6O2/c1-8(19)13-10-15-11(14-9(2)20)17-12(16-10)18-6-4-3-5-7-18/h3-7H2,1-2H3,(H2,13,14,15,16,17,19,20)
InChIKeyBGVOFXKXVZGAMO-UHFFFAOYSA-N
XLogP0.78
TPSA100.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide?
The IUPAC name of N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide (CID 2730056) is N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide.
What is the SMILES notation for N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide?
The canonical SMILES for N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide is CC(=O)Nc1nc(NC(C)=O)nc(N2CCCCC2)n1.
What is the InChIKey of N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide?
The InChIKey is BGVOFXKXVZGAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O2/c1-8(19)13-10-15-11(14-9(2)20)17-12(16-10)18-6-4-3-5-7-18/h3-7H2,1-2H3,(H2,13,14,15,16,17,19,20).
What are the key properties of N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide?
N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide has a molecular weight of 278.32 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetamide is sourced from PubChem (CID 2730056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).