2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide

C14H22N4O2 — CID 95857433

IUPAC2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide
SMILESCc1nc(N)n(CC(=O)NC2CCCCC2)c(=O)c1C
InChIInChI=1S/C14H22N4O2/c1-9-10(2)16-14(15)18(13(9)20)8-12(19)17-11-6-4-3-5-7-11/h11H,3-8H2,1-2H3,(H2,15,16)(H,17,19)
InChIKeyGCZFFQMMNHDKDJ-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.89
Rot. Bonds3

About 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide

2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide (PubChem CID 95857433) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide
PubChem CID95857433
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide
SMILESCc1nc(N)n(CC(=O)NC2CCCCC2)c(=O)c1C
InChIInChI=1S/C14H22N4O2/c1-9-10(2)16-14(15)18(13(9)20)8-12(19)17-11-6-4-3-5-7-11/h11H,3-8H2,1-2H3,(H2,15,16)(H,17,19)
InChIKeyGCZFFQMMNHDKDJ-UHFFFAOYSA-N
XLogP0.89
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide?
The IUPAC name of 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide (CID 95857433) is 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide?
The canonical SMILES for 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide is Cc1nc(N)n(CC(=O)NC2CCCCC2)c(=O)c1C.
What is the InChIKey of 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide?
The InChIKey is GCZFFQMMNHDKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-9-10(2)16-14(15)18(13(9)20)8-12(19)17-11-6-4-3-5-7-11/h11H,3-8H2,1-2H3,(H2,15,16)(H,17,19).
What are the key properties of 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide?
2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide has a molecular weight of 278.36 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-cyclohexylacetamide is sourced from PubChem (CID 95857433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).