N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide

C14H21N3O3 — CID 79375765

IUPACN-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCOc1nc(C)cc(=O)n1CC(=O)NC1CCCCC1
InChIInChI=1S/C14H21N3O3/c1-10-8-13(19)17(14(15-10)20-2)9-12(18)16-11-6-4-3-5-7-11/h8,11H,3-7,9H2,1-2H3,(H,16,18)
InChIKeyUQQYBJWHNNFRQC-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.01
Rot. Bonds4

About N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide

N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide (PubChem CID 79375765) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
PubChem CID79375765
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC NameN-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCOc1nc(C)cc(=O)n1CC(=O)NC1CCCCC1
InChIInChI=1S/C14H21N3O3/c1-10-8-13(19)17(14(15-10)20-2)9-12(18)16-11-6-4-3-5-7-11/h8,11H,3-7,9H2,1-2H3,(H,16,18)
InChIKeyUQQYBJWHNNFRQC-UHFFFAOYSA-N
XLogP1.01
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide (CID 79375765) is N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide is COc1nc(C)cc(=O)n1CC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The InChIKey is UQQYBJWHNNFRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-10-8-13(19)17(14(15-10)20-2)9-12(18)16-11-6-4-3-5-7-11/h8,11H,3-7,9H2,1-2H3,(H,16,18).
What are the key properties of N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide has a molecular weight of 279.34 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 79375765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).