N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide

C13H20N4O3 — CID 136664947

IUPACN-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide
SMILESCc1cc(=O)[nH]c(CCNC(=O)CN2CCOCC2)n1
InChIInChI=1S/C13H20N4O3/c1-10-8-12(18)16-11(15-10)2-3-14-13(19)9-17-4-6-20-7-5-17/h8H,2-7,9H2,1H3,(H,14,19)(H,15,16,18)
InChIKeyRMFGGGUSUDYOIC-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.93
Rot. Bonds5

About N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide

N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide (PubChem CID 136664947) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide
PubChem CID136664947
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC NameN-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide
SMILESCc1cc(=O)[nH]c(CCNC(=O)CN2CCOCC2)n1
InChIInChI=1S/C13H20N4O3/c1-10-8-12(18)16-11(15-10)2-3-14-13(19)9-17-4-6-20-7-5-17/h8H,2-7,9H2,1H3,(H,14,19)(H,15,16,18)
InChIKeyRMFGGGUSUDYOIC-UHFFFAOYSA-N
XLogP-0.93
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-Methyl-2-(morpholinomethyl)-4-pyrimidinol
CID 135408235
2-Cyclopropyl-6-(morpholinomethyl)-4-pyrimidinol
CID 135399221
2-Methyl-6-(morpholinomethyl)-4-pyrimidinol
CID 135452238
6-[(2,6-Dimethylmorpholino)methyl]-2-isopropyl-4-pyrimidinol
CID 135501747
2-Isopropyl-6-(morpholinomethyl)-4-pyrimidinol
CID 135486292
4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 136844271
1-Methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide
CID 141087183
1-Methyl-2-(2-morpholin-4-ylethyl)-6-oxopyrimidine-4-carboxamide
CID 150229737
2,6-Dimethyl-3-(2-morpholin-4-yl-2-oxoethyl)pyrimidin-4-one
CID 7748970
3-[2-(2-Ethoxyethylamino)ethyl]-2,6-dimethylpyrimidin-4-one
CID 55235877
2,6-Dimethyl-3-(2-oxo-2-piperazin-1-ylethyl)pyrimidin-4-one
CID 55261962
3-(3-Amino-2-ethoxypropyl)-2,6-dimethylpyrimidin-4-one
CID 63768817

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide (CID 136664947) is N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide is Cc1cc(=O)[nH]c(CCNC(=O)CN2CCOCC2)n1.
What is the InChIKey of N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide?
The InChIKey is RMFGGGUSUDYOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-10-8-12(18)16-11(15-10)2-3-14-13(19)9-17-4-6-20-7-5-17/h8H,2-7,9H2,1H3,(H,14,19)(H,15,16,18).
What are the key properties of N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide?
N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide has a molecular weight of 280.33 g/mol, XLogP of -0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 136664947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).