N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide

C15H23N3O3 — CID 38306720

IUPACN-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCn1c(=O)ccn(CC(=O)NCCC2CCCCC2)c1=O
InChIInChI=1S/C15H23N3O3/c1-17-14(20)8-10-18(15(17)21)11-13(19)16-9-7-12-5-3-2-4-6-12/h8,10,12H,2-7,9,11H2,1H3,(H,16,19)
InChIKeyLJQJLPMFTGFHSN-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.63
Rot. Bonds5

About N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide

N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 38306720) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID38306720
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCn1c(=O)ccn(CC(=O)NCCC2CCCCC2)c1=O
InChIInChI=1S/C15H23N3O3/c1-17-14(20)8-10-18(15(17)21)11-13(19)16-9-7-12-5-3-2-4-6-12/h8,10,12H,2-7,9,11H2,1H3,(H,16,19)
InChIKeyLJQJLPMFTGFHSN-UHFFFAOYSA-N
XLogP0.63
TPSA73.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide (CID 38306720) is N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide is Cn1c(=O)ccn(CC(=O)NCCC2CCCCC2)c1=O.
What is the InChIKey of N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is LJQJLPMFTGFHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-17-14(20)8-10-18(15(17)21)11-13(19)16-9-7-12-5-3-2-4-6-12/h8,10,12H,2-7,9,11H2,1H3,(H,16,19).
What are the key properties of N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 38306720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).