2-methoxy-N-pyrimidin-4-ylacetamide

C7H9N3O2 — CID 110460486

IUPAC2-methoxy-N-pyrimidin-4-ylacetamide
SMILESCOCC(=O)Nc1ccncn1
InChIInChI=1S/C7H9N3O2/c1-12-4-7(11)10-6-2-3-8-5-9-6/h2-3,5H,4H2,1H3,(H,8,9,10,11)
InChIKeyCQQVLKCASHCJDB-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.06
Rot. Bonds3

About 2-methoxy-N-pyrimidin-4-ylacetamide

2-methoxy-N-pyrimidin-4-ylacetamide (PubChem CID 110460486) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 2-methoxy-N-pyrimidin-4-ylacetamide.

Molecular Properties

Compound Name2-methoxy-N-pyrimidin-4-ylacetamide
PubChem CID110460486
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name2-methoxy-N-pyrimidin-4-ylacetamide
SMILESCOCC(=O)Nc1ccncn1
InChIInChI=1S/C7H9N3O2/c1-12-4-7(11)10-6-2-3-8-5-9-6/h2-3,5H,4H2,1H3,(H,8,9,10,11)
InChIKeyCQQVLKCASHCJDB-UHFFFAOYSA-N
XLogP0.06
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyrimidin-4-ylbutanamide
CID 130272746
N-pyrimidin-4-ylacetamide;hydrochloride
CID 126797028
N-pyrimidin-4-yltetradecanamide
CID 54258014
2-methoxy-N-(4-methyl-2-pyridinyl)acetamide
CID 23657944
2-methoxy-N-[3-(pyrimidin-4-ylmethylamino)phenyl]acetamide
CID 62748713
methyl N-[2-[2-oxo-2-(pyrimidin-4-ylamino)ethyl]triazol-4-yl]carbamate
CID 112524310
2-amino-2-methyl-N-pyrimidin-4-ylpropanamide
CID 83617917
(2S,3S)-2-amino-3-methyl-N-pyrimidin-4-ylpentanamide
CID 110837827
2-methyl-3-(methylamino)-N-pyrimidin-4-ylpropanamide
CID 83618247
N-[4-(hydroxymethyl)-2-pyridinyl]-2-methoxyacetamide
CID 82343554
2-methoxy-N-(2-methoxy-4-pyridinyl)acetamide
CID 130524601
N-methylpyrimidin-4-amine;propanedioic acid
CID 70381240

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-pyrimidin-4-ylacetamide?
The IUPAC name of 2-methoxy-N-pyrimidin-4-ylacetamide (CID 110460486) is 2-methoxy-N-pyrimidin-4-ylacetamide.
What is the SMILES notation for 2-methoxy-N-pyrimidin-4-ylacetamide?
The canonical SMILES for 2-methoxy-N-pyrimidin-4-ylacetamide is COCC(=O)Nc1ccncn1.
What is the InChIKey of 2-methoxy-N-pyrimidin-4-ylacetamide?
The InChIKey is CQQVLKCASHCJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-12-4-7(11)10-6-2-3-8-5-9-6/h2-3,5H,4H2,1H3,(H,8,9,10,11).
What are the key properties of 2-methoxy-N-pyrimidin-4-ylacetamide?
2-methoxy-N-pyrimidin-4-ylacetamide has a molecular weight of 167.17 g/mol, XLogP of 0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-pyrimidin-4-ylacetamide is sourced from PubChem (CID 110460486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).