N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide

C13H19N3O3 — CID 102635565

IUPACN-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCN(C(=O)Cn1cccnc1=O)C1CCCCC1O
InChIInChI=1S/C13H19N3O3/c1-15(10-5-2-3-6-11(10)17)12(18)9-16-8-4-7-14-13(16)19/h4,7-8,10-11,17H,2-3,5-6,9H2,1H3
InChIKeyMFCQCBPCAOHDSE-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.01
Rot. Bonds3

About N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide

N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide (PubChem CID 102635565) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide
PubChem CID102635565
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCN(C(=O)Cn1cccnc1=O)C1CCCCC1O
InChIInChI=1S/C13H19N3O3/c1-15(10-5-2-3-6-11(10)17)12(18)9-16-8-4-7-14-13(16)19/h4,7-8,10-11,17H,2-3,5-6,9H2,1H3
InChIKeyMFCQCBPCAOHDSE-UHFFFAOYSA-N
XLogP0.01
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide (CID 102635565) is N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide is CN(C(=O)Cn1cccnc1=O)C1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide?
The InChIKey is MFCQCBPCAOHDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-15(10-5-2-3-6-11(10)17)12(18)9-16-8-4-7-14-13(16)19/h4,7-8,10-11,17H,2-3,5-6,9H2,1H3.
What are the key properties of N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide?
N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide has a molecular weight of 265.31 g/mol, XLogP of 0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 102635565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).