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

C15H23N3O2 — CID 46304534

IUPACN-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide
SMILESCc1cc(C)n(C(C)C(=O)NC2CCCCC2)c(=O)n1
InChIInChI=1S/C15H23N3O2/c1-10-9-11(2)18(15(20)16-10)12(3)14(19)17-13-7-5-4-6-8-13/h9,12-13H,4-8H2,1-3H3,(H,17,19)
InChIKeyMKOLARJVGUAJRZ-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.87
Rot. Bonds3

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

N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide (PubChem CID 46304534) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide
PubChem CID46304534
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide
SMILESCc1cc(C)n(C(C)C(=O)NC2CCCCC2)c(=O)n1
InChIInChI=1S/C15H23N3O2/c1-10-9-11(2)18(15(20)16-10)12(3)14(19)17-13-7-5-4-6-8-13/h9,12-13H,4-8H2,1-3H3,(H,17,19)
InChIKeyMKOLARJVGUAJRZ-UHFFFAOYSA-N
XLogP1.87
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-[(1S,2R)-2-fluorocyclopentyl]acetamide
CID 137981272
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-(3-fluoro-3-methylcyclobutyl)acetamide
CID 137993544
(2R)-2-amino-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-4-methylpentanamide
CID 56871875
4,6-Dimethyl-1-(2-oxo-2-piperazin-1-ylethyl)pyrimidin-2-one
CID 24699830
N-cycloheptyl-N'-[2-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)ethyl]succinamide
CID 46995237
N-cyclohexyl-2-{[2-(4,6-dimethyl-2-oxopyrimidin-1(2H)-yl)ethyl]amino}butanamide
CID 50980300
1-[2-(Heptan-2-ylamino)ethyl]-4,6-dimethylpyrimidin-2-one
CID 55087976
N-[(1S*,2R*)-2-aminocyclobutyl]-2-(4,6-dimethyl-2-oxo-1(2H)-pyrimidinyl)acetamide
CID 56916116
4,6-Dimethyl-1-(piperidin-2-ylmethyl)pyrimidin-2-one
CID 61686053
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 62018236
4,6-Dimethyl-1-[2-(propylamino)pentyl]pyrimidin-2-one
CID 62043835
1-[2-(Ethylamino)pentyl]-4,6-dimethylpyrimidin-2-one
CID 62043836

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide?
The IUPAC name of N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide (CID 46304534) is N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide?
The canonical SMILES for N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide is Cc1cc(C)n(C(C)C(=O)NC2CCCCC2)c(=O)n1.
What is the InChIKey of N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide?
The InChIKey is MKOLARJVGUAJRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-9-11(2)18(15(20)16-10)12(3)14(19)17-13-7-5-4-6-8-13/h9,12-13H,4-8H2,1-3H3,(H,17,19).
What are the key properties of N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide?
N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide has a molecular weight of 277.37 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanamide is sourced from PubChem (CID 46304534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).