3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide

C15H23N3O3 — CID 2148477

IUPAC3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide
SMILESCn1c(NC(=O)CCC2CCCCC2)cc(=O)n(C)c1=O
InChIInChI=1S/C15H23N3O3/c1-17-12(10-14(20)18(2)15(17)21)16-13(19)9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,19)
InChIKeyYXMRLWJUDLJHQZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.38
Rot. Bonds4

About 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide

3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide (PubChem CID 2148477) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide
PubChem CID2148477
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide
SMILESCn1c(NC(=O)CCC2CCCCC2)cc(=O)n(C)c1=O
InChIInChI=1S/C15H23N3O3/c1-17-12(10-14(20)18(2)15(17)21)16-13(19)9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,19)
InChIKeyYXMRLWJUDLJHQZ-UHFFFAOYSA-N
XLogP1.38
TPSA73.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide (CID 2148477) is 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide is Cn1c(NC(=O)CCC2CCCCC2)cc(=O)n(C)c1=O.
What is the InChIKey of 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide?
The InChIKey is YXMRLWJUDLJHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-17-12(10-14(20)18(2)15(17)21)16-13(19)9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,19).
What are the key properties of 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide?
3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide has a molecular weight of 293.37 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)propanamide is sourced from PubChem (CID 2148477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).