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

C18H28N4O3 — CID 53201811

IUPACN-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)N(C)C2CCCCC2)c(N2CCOCC2)n1
InChIInChI=1S/C18H28N4O3/c1-14-12-16(23)22(18(19-14)21-8-10-25-11-9-21)13-17(24)20(2)15-6-4-3-5-7-15/h12,15H,3-11,13H2,1-2H3
InChIKeyYRTJDDCNFJKZOP-UHFFFAOYSA-N
MW348.45 g/mol
LogP1.18
Rot. Bonds4

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

N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide (PubChem CID 53201811) has the molecular formula C18H28N4O3 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide
PubChem CID53201811
Molecular FormulaC18H28N4O3
Molecular Weight348.45 g/mol
Exact Mass348.22
IUPAC NameN-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)N(C)C2CCCCC2)c(N2CCOCC2)n1
InChIInChI=1S/C18H28N4O3/c1-14-12-16(23)22(18(19-14)21-8-10-25-11-9-21)13-17(24)20(2)15-6-4-3-5-7-15/h12,15H,3-11,13H2,1-2H3
InChIKeyYRTJDDCNFJKZOP-UHFFFAOYSA-N
XLogP1.18
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide (CID 53201811) is N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide is Cc1cc(=O)n(CC(=O)N(C)C2CCCCC2)c(N2CCOCC2)n1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide?
The InChIKey is YRTJDDCNFJKZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O3/c1-14-12-16(23)22(18(19-14)21-8-10-25-11-9-21)13-17(24)20(2)15-6-4-3-5-7-15/h12,15H,3-11,13H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide?
N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide has a molecular weight of 348.45 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-(4-methyl-2-morpholin-4-yl-6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 53201811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).