2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

C20H25N3O3 — CID 136756312

IUPAC2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCCc1nc(C)c(CC(=O)N[C@@H]2CCCc3cc(OC)ccc32)c(=O)[nH]1
InChIInChI=1S/C20H25N3O3/c1-4-18-21-12(2)16(20(25)23-18)11-19(24)22-17-7-5-6-13-10-14(26-3)8-9-15(13)17/h8-10,17H,4-7,11H2,1-3H3,(H,22,24)(H,21,23,25)/t17-/m1/s1
InChIKeyROVGUFYMHXSXSM-QGZVFWFLSA-N
MW355.44 g/mol
LogP2.39
Rot. Bonds5

About 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 136756312) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound Name2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
PubChem CID136756312
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCCc1nc(C)c(CC(=O)N[C@@H]2CCCc3cc(OC)ccc32)c(=O)[nH]1
InChIInChI=1S/C20H25N3O3/c1-4-18-21-12(2)16(20(25)23-18)11-19(24)22-17-7-5-6-13-10-14(26-3)8-9-15(13)17/h8-10,17H,4-7,11H2,1-3H3,(H,22,24)(H,21,23,25)/t17-/m1/s1
InChIKeyROVGUFYMHXSXSM-QGZVFWFLSA-N
XLogP2.39
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[[(3S)-7-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]acetamide
CID 136696882
2-(2-chlorophenyl)-N-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 100633564
4-chloro-N-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]butanamide
CID 129365353
3-(2-ethylimidazol-1-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide
CID 125176327
N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)acetamide;dihydrochloride
CID 137081429
2-(5-acetylthiophen-3-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 125178703
N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,2-dimethylpropanamide
CID 98004897
4-(4-methoxy-N-methylsulfonylanilino)-N-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]butanamide
CID 125063902
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide
CID 91793858
(2R)-2-amino-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119289450
2-amino-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-6-methylpyrimidine-4-carboxamide
CID 125157762
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 43901658

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (CID 136756312) is 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is CCc1nc(C)c(CC(=O)N[C@@H]2CCCc3cc(OC)ccc32)c(=O)[nH]1.
What is the InChIKey of 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is ROVGUFYMHXSXSM-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-4-18-21-12(2)16(20(25)23-18)11-19(24)22-17-7-5-6-13-10-14(26-3)8-9-15(13)17/h8-10,17H,4-7,11H2,1-3H3,(H,22,24)(H,21,23,25)/t17-/m1/s1.
What are the key properties of 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 355.44 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 136756312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).