N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide

C12H17N3O2 — CID 56764424

IUPACN-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCc1cncn(CC(=O)NC2CCCC2)c1=O
InChIInChI=1S/C12H17N3O2/c1-9-6-13-8-15(12(9)17)7-11(16)14-10-4-2-3-5-10/h6,8,10H,2-5,7H2,1H3,(H,14,16)
InChIKeyNUYSWJPFFYCGIN-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.61
Rot. Bonds3

About N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide

N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide (PubChem CID 56764424) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide
PubChem CID56764424
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCc1cncn(CC(=O)NC2CCCC2)c1=O
InChIInChI=1S/C12H17N3O2/c1-9-6-13-8-15(12(9)17)7-11(16)14-10-4-2-3-5-10/h6,8,10H,2-5,7H2,1H3,(H,14,16)
InChIKeyNUYSWJPFFYCGIN-UHFFFAOYSA-N
XLogP0.61
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide (CID 56764424) is N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide is Cc1cncn(CC(=O)NC2CCCC2)c1=O.
What is the InChIKey of N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide?
The InChIKey is NUYSWJPFFYCGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-9-6-13-8-15(12(9)17)7-11(16)14-10-4-2-3-5-10/h6,8,10H,2-5,7H2,1H3,(H,14,16).
What are the key properties of N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide?
N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide has a molecular weight of 235.29 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(5-methyl-6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 56764424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).