N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide

C8H11N3O2 — CID 161009995

IUPACN-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1coc2c1CNCN2
InChIInChI=1S/C8H11N3O2/c1-5(12)11-7-3-13-8-6(7)2-9-4-10-8/h3,9-10H,2,4H2,1H3,(H,11,12)
InChIKeySJFGKFPKOCDUJU-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.71
Rot. Bonds1

About N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide

N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide (PubChem CID 161009995) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide
PubChem CID161009995
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1coc2c1CNCN2
InChIInChI=1S/C8H11N3O2/c1-5(12)11-7-3-13-8-6(7)2-9-4-10-8/h3,9-10H,2,4H2,1H3,(H,11,12)
InChIKeySJFGKFPKOCDUJU-UHFFFAOYSA-N
XLogP0.71
TPSA66.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide?
The IUPAC name of N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide (CID 161009995) is N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide?
The canonical SMILES for N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide is CC(=O)Nc1coc2c1CNCN2.
What is the InChIKey of N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide?
The InChIKey is SJFGKFPKOCDUJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-5(12)11-7-3-13-8-6(7)2-9-4-10-8/h3,9-10H,2,4H2,1H3,(H,11,12).
What are the key properties of N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide?
N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide has a molecular weight of 181.19 g/mol, XLogP of 0.71, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydrofuro[2,3-d]pyrimidin-5-yl)acetamide is sourced from PubChem (CID 161009995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).