2-amino-1-(2-methylpyrimidin-5-yl)ethanone

C7H9N3O — CID 82594840

IUPAC2-amino-1-(2-methylpyrimidin-5-yl)ethanone
SMILESCc1ncc(C(=O)CN)cn1
InChIInChI=1S/C7H9N3O/c1-5-9-3-6(4-10-5)7(11)2-8/h3-4H,2,8H2,1H3
InChIKeyYEUBVJQEIUQCJW-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.07
Rot. Bonds2

About 2-amino-1-(2-methylpyrimidin-5-yl)ethanone

2-amino-1-(2-methylpyrimidin-5-yl)ethanone (PubChem CID 82594840) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 2-amino-1-(2-methylpyrimidin-5-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(2-methylpyrimidin-5-yl)ethanone
PubChem CID82594840
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name2-amino-1-(2-methylpyrimidin-5-yl)ethanone
SMILESCc1ncc(C(=O)CN)cn1
InChIInChI=1S/C7H9N3O/c1-5-9-3-6(4-10-5)7(11)2-8/h3-4H,2,8H2,1H3
InChIKeyYEUBVJQEIUQCJW-UHFFFAOYSA-N
XLogP-0.07
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-1-(2-methylpyrimidin-5-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(methylamino)-1-(2-methylpyrimidin-5-yl)butan-1-one
CID 83818309
1-[2-(2-methylpyrimidin-5-yl)-2-oxoethyl]cyclopropane-1-carboxylic acid
CID 146940341
2-amino-1-(6-chloro-3-pyridinyl)ethanone;hydrochloride
CID 88879940
2,2,2-trichloro-1-(2-methylpyrimidin-5-yl)ethanone
CID 57220184
iodo 2-methylpyrimidine-5-carboxylate
CID 147193556
2-amino-1-(4-methylpyrimidin-5-yl)ethanone
CID 82417351
2-amino-1-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 84767265
2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride
CID 141116458
2-amino-1-(2-chloro-3-methylimidazol-4-yl)ethanone
CID 164644986
2-amino-1-(5-ethyl-3-pyridinyl)ethanone
CID 84651885
2-amino-1-[2-[[1-(3-methylphenyl)cyclobutyl]methyl]pyrimidin-5-yl]ethanone
CID 157226916
2-(2-methylpyrimidin-5-yl)acetohydrazide
CID 46705518

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-methylpyrimidin-5-yl)ethanone?
The IUPAC name of 2-amino-1-(2-methylpyrimidin-5-yl)ethanone (CID 82594840) is 2-amino-1-(2-methylpyrimidin-5-yl)ethanone.
What is the SMILES notation for 2-amino-1-(2-methylpyrimidin-5-yl)ethanone?
The canonical SMILES for 2-amino-1-(2-methylpyrimidin-5-yl)ethanone is Cc1ncc(C(=O)CN)cn1.
What is the InChIKey of 2-amino-1-(2-methylpyrimidin-5-yl)ethanone?
The InChIKey is YEUBVJQEIUQCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-5-9-3-6(4-10-5)7(11)2-8/h3-4H,2,8H2,1H3.
What are the key properties of 2-amino-1-(2-methylpyrimidin-5-yl)ethanone?
2-amino-1-(2-methylpyrimidin-5-yl)ethanone has a molecular weight of 151.17 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-methylpyrimidin-5-yl)ethanone is sourced from PubChem (CID 82594840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).