N-(1,2-dihydropyrimidin-2-yl)acetamide

C6H9N3O — CID 173468816

IUPACN-(1,2-dihydropyrimidin-2-yl)acetamide
SMILESCC(=O)NC1N=CC=CN1
InChIInChI=1S/C6H9N3O/c1-5(10)9-6-7-3-2-4-8-6/h2-4,6-7H,1H3,(H,9,10)
InChIKeyBHZSQVRKZWSGPL-UHFFFAOYSA-N
MW139.16 g/mol
LogP-0.41
Rot. Bonds1

About N-(1,2-dihydropyrimidin-2-yl)acetamide

N-(1,2-dihydropyrimidin-2-yl)acetamide (PubChem CID 173468816) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is N-(1,2-dihydropyrimidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(1,2-dihydropyrimidin-2-yl)acetamide
PubChem CID173468816
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC NameN-(1,2-dihydropyrimidin-2-yl)acetamide
SMILESCC(=O)NC1N=CC=CN1
InChIInChI=1S/C6H9N3O/c1-5(10)9-6-7-3-2-4-8-6/h2-4,6-7H,1H3,(H,9,10)
InChIKeyBHZSQVRKZWSGPL-UHFFFAOYSA-N
XLogP-0.41
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydropyrimidin-2-yl)acetamide?
The IUPAC name of N-(1,2-dihydropyrimidin-2-yl)acetamide (CID 173468816) is N-(1,2-dihydropyrimidin-2-yl)acetamide.
What is the SMILES notation for N-(1,2-dihydropyrimidin-2-yl)acetamide?
The canonical SMILES for N-(1,2-dihydropyrimidin-2-yl)acetamide is CC(=O)NC1N=CC=CN1.
What is the InChIKey of N-(1,2-dihydropyrimidin-2-yl)acetamide?
The InChIKey is BHZSQVRKZWSGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-5(10)9-6-7-3-2-4-8-6/h2-4,6-7H,1H3,(H,9,10).
What are the key properties of N-(1,2-dihydropyrimidin-2-yl)acetamide?
N-(1,2-dihydropyrimidin-2-yl)acetamide has a molecular weight of 139.16 g/mol, XLogP of -0.41, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydropyrimidin-2-yl)acetamide is sourced from PubChem (CID 173468816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).