2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide

C15H23N3O2 — CID 121119113

IUPAC2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide
SMILESCc1cc(=O)n(CCNC(=O)CC2CCCCC2)cn1
InChIInChI=1S/C15H23N3O2/c1-12-9-15(20)18(11-17-12)8-7-16-14(19)10-13-5-3-2-4-6-13/h9,11,13H,2-8,10H2,1H3,(H,16,19)
InChIKeyOZTAHXKEHUOPJI-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.64
Rot. Bonds5

About 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide

2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide (PubChem CID 121119113) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide
PubChem CID121119113
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide
SMILESCc1cc(=O)n(CCNC(=O)CC2CCCCC2)cn1
InChIInChI=1S/C15H23N3O2/c1-12-9-15(20)18(11-17-12)8-7-16-14(19)10-13-5-3-2-4-6-13/h9,11,13H,2-8,10H2,1H3,(H,16,19)
InChIKeyOZTAHXKEHUOPJI-UHFFFAOYSA-N
XLogP1.64
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyl-N-[2-[4-(4-fluorophenyl)-6-oxopyrimidin-1-yl]ethyl]acetamide
CID 90516017
2-cyclopentyl-N-[2-(6-oxopyrimidin-1-yl)ethyl]acetamide
CID 121121461
2-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide
CID 121119335
2-cyclohexyl-N-[2-[(2,5-dimethylpyrazol-3-yl)carbamoylamino]ethyl]acetamide
CID 47093320
N-[2-(4,5-dimethyl-6-oxopyrimidin-1-yl)ethyl]-2-(4-methyl-6-oxopyrimidin-1-yl)acetamide
CID 121120827
N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]-2-(4-nitrophenyl)acetamide
CID 121119206
N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]-2-pyridin-3-yloxyacetamide
CID 121119286
N-[2-(4-cyclopentyl-6-oxopyrimidin-1-yl)ethyl]-3-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 121120534
2-cyclohexyl-N-[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]ethyl]acetamide
CID 18569655
N-[2-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]ethyl]-2-cyclohexylacetamide
CID 18569732
3-[2-(2-aminocyclopentyl)ethyl]-6-methylpyrimidin-4-one
CID 79572644
3-(3-but-3-ynyldiazirin-3-yl)-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]propanamide
CID 167901543

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide (CID 121119113) is 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide is Cc1cc(=O)n(CCNC(=O)CC2CCCCC2)cn1.
What is the InChIKey of 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide?
The InChIKey is OZTAHXKEHUOPJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12-9-15(20)18(11-17-12)8-7-16-14(19)10-13-5-3-2-4-6-13/h9,11,13H,2-8,10H2,1H3,(H,16,19).
What are the key properties of 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide?
2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-(4-methyl-6-oxopyrimidin-1-yl)ethyl]acetamide is sourced from PubChem (CID 121119113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).