2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide

C6H11N3O — CID 22056455

IUPAC2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide
SMILESNC(=O)CC1=NCCCN1
InChIInChI=1S/C6H11N3O/c7-5(10)4-6-8-2-1-3-9-6/h1-4H2,(H2,7,10)(H,8,9)
InChIKeySBQZFVIXSDNZFS-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.75
Rot. Bonds2

About 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide

2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide (PubChem CID 22056455) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide.

Molecular Properties

Compound Name2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide
PubChem CID22056455
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide
SMILESNC(=O)CC1=NCCCN1
InChIInChI=1S/C6H11N3O/c7-5(10)4-6-8-2-1-3-9-6/h1-4H2,(H2,7,10)(H,8,9)
InChIKeySBQZFVIXSDNZFS-UHFFFAOYSA-N
XLogP-0.75
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide 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

2-(2-Aminoethyl)-5-fluoro-1,4,5,6-tetrahydropyrimidine-4,6-dione
CID 80550490
2-(3-aminopropyl)-5-fluoro-1H-pyrimidine-4,6-dione
CID 80550516
5-fluoro-2-[2-(methylamino)ethyl]-1H-pyrimidine-4,6-dione
CID 80550862
2-methyl-4,5-dihydro-1H-pyrimidin-6-one
CID 19432054
3-(Methylamino)-3-methyliminopropanamide
CID 22056440
3-(Ethylamino)-3-ethyliminopropanamide
CID 22056443
2-propan-2-yl-4,5-dihydro-1H-pyrimidin-6-one
CID 22898627
2-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylacetamide
CID 54336256
2,5-dimethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 55287748
3-amino-N-methyl-3-methyliminopropanamide
CID 58823165
2-(4,5-dihydro-1H-imidazol-2-yl)propanamide
CID 69194733
2-ethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 69298206

Frequently Asked Questions

What is the IUPAC name of 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide?
The IUPAC name of 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide (CID 22056455) is 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide.
What is the SMILES notation for 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide?
The canonical SMILES for 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide is NC(=O)CC1=NCCCN1.
What is the InChIKey of 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide?
The InChIKey is SBQZFVIXSDNZFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c7-5(10)4-6-8-2-1-3-9-6/h1-4H2,(H2,7,10)(H,8,9).
What are the key properties of 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide?
2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide has a molecular weight of 141.17 g/mol, XLogP of -0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4,5,6-tetrahydropyrimidin-2-yl)acetamide is sourced from PubChem (CID 22056455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).